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Screening compounds

Complement factor D-IN-1

Also known as Complement?factor?D-IN-1, 1-[2-[(1R,3S,5R)-3-[(6-bromopyridin-2-yl)carbamoyl]-2-azabicyclo[3.1.0]hexan-2-yl]-2-oxoethyl]indazole-3-carboxamide, 1-(2-((1R,3S,5R)-3-((6-Bromopyridin-2-yl)carbamoyl)-2-azabicyclo[3.1.0]hexan-2-yl)-2-oxoethyl)-1H-indazole-3-carboxamide

CAS 1386455-76-0Formula C21H19BrN6O3Molar mass 483.33 g/mol
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Complement factor D-IN-1 chemical structure, C21H19BrN6O3, CAS 1386455-76-0
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
1386455-76-0
Formula
C21H19BrN6O3
Molar mass
483.33 g/mol
HS code
293339
Category
Screening compounds

What is Complement factor D-IN-1?

Plain description, key identifiers and synonyms

Complement factor D-IN-1 is a chemical substance with the molecular formula C21H19BrN6O3 and a molar mass of 483.33 g/mol. Its CAS registry number is 1386455-76-0. The IUPAC name is 1-[2-[(1R,3S,5R)-3-[(6-bromo-2-pyridinyl)carbamoyl]-2-azabicyclo[3.1.0]hexan-2-yl]-2-oxoethyl]indazole-3-carboxamide.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
1-[2-[(1R,3S,5R)-3-[(6-bromo-2-pyridinyl)carbamoyl]-2-azabicyclo[3.1.0]hexan-2-yl]-2-oxoethyl]indazole-3-carboxamide
CAS number
1386455-76-0
Molecular formula
C21H19BrN6O3
MDL number
MFCD31657336
InChIKey
CWZUTHDJLNZLCM-DFBGVHRSSA-N
InChI
InChI=1S/C21H19BrN6O3/c22-16-6-3-7-17(24-16)25-21(31)15-9-11-8-14(11)28(15)18(29)10-27-13-5-2-1-4-12(13)19(26-27)20(23)30/h1-7,11,14-15H,8-10H2,(H2,23,30)(H,24,25,31)/t11-,14-,15+/m1/s1
Canonical SMILES
NC(=O)c1nn(CC(=O)N2C(C(=O)Nc3cccc(Br)n3)CC3CC32)c2ccccc12
Isomeric SMILES
C1[C@H]2[C@@H]1N([C@@H](C2)C(=O)NC3=NC(=CC=C3)Br)C(=O)CN4C5=CC=CC=C5C(=N4)C(=O)N

Synonyms

  • Complement?factor?D-IN-1
  • 1-[2-[(1R,3S,5R)-3-[(6-bromopyridin-2-yl)carbamoyl]-2-azabicyclo[3.1.0]hexan-2-yl]-2-oxoethyl]indazole-3-carboxamide
  • 1-(2-((1R,3S,5R)-3-((6-Bromopyridin-2-yl)carbamoyl)-2-azabicyclo[3.1.0]hexan-2-yl)-2-oxoethyl)-1H-indazole-3-carboxamide
  • 1-[2-[(1~{r},3~{s},5~{r})-3-[(6-Bromanylpyridin-2-Yl)carbamoyl]-2-Azabicyclo[3.1.0]hexan-2-Yl]-2-Oxidanylidene-Ethyl]indazole-3-Carboxamide
  • 1-[2-[(1R,3S,5R)-3-[(6-Bromopyridin-2-yl)carbamoyl]-2-azabicyclo[3.1.0]hexan-2-yl]-2-oxoethyl]-1H-indazole-3-carboxamide
  • C21H19BrN6O3
  • compound 2
  • example 727
  • US9085555, 727
  • 1-[2-[(1R,3S,5R)-3-[(6-bromo-2-pyridyl)carbamoyl]-2-azabicyclo[3.1.0]hexan-2-yl]-2-oxo-ethyl]indazole-3-carboxamide
  • 1-{2-[(1R,3S,5R)-3-(6-Bromo-pyridin-2-ylcarbamoyl)-2-aza-bicyclo[3.1.0]hex-2-yl]-2-oxo-ethyl}-1H-indazole-3-carboxylic acid amide

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
483.33 g/molcalc.
Exact mass
482.0702 Dacalc.
LogP (octanol/water)
1.92calc.
Topological polar surface area
123.2 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
5calc.
Rotatable bonds
5calc.
Heavy atoms
31calc.
Rings
5calc.
Aromatic rings
3calc.
Fraction sp3 carbons
0.29calc.
Formal charge
0calc.
Stereocentres
3calc.
Lipinski rule of five
Passes (0 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, O=C(Nc1ccccn1)C1CC2CC2N1C(=O)Cn1ncc2ccccc21

O=C(Nc1ccccn1)C1CC2CC2N1C(=O)Cn1ncc2ccccc21

5 rings, 27 atoms.

No other chemical in our database has this scaffold.

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Complement factor D-IN-1 suppliers

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Complement factor D-IN-1 price

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Uses and applications

What the substance is used for, by industry and function

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Complement factor D-IN-1 is traded under.

HS 2933.39Indicative HS code

Heterocyclic compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure…

World exports in 2024
$9.16B
−17.9% vs 2023, imports $10.6B
2019 to 2024
Top exporters
  1. China21.5%
  2. India * partner reported12.3%
  3. Ireland11.6%
Top importers
  1. Germany14.2%
  2. United States12.8%
  3. Brazil10.1%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Complement factor D-IN-1 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Complement factor D-IN-1, based on the data on this page

What is Complement factor D-IN-1?

Complement factor D-IN-1 is a chemical substance with the molecular formula C21H19BrN6O3 and a molar mass of 483.33 g/mol. Its CAS registry number is 1386455-76-0. The IUPAC name is 1-[2-[(1R,3S,5R)-3-[(6-bromo-2-pyridinyl)carbamoyl]-2-azabicyclo[3.1.0]hexan-2-yl]-2-oxoethyl]indazole-3-carboxamide.

What is the CAS number of Complement factor D-IN-1?

The CAS registry number of Complement factor D-IN-1 is 1386455-76-0.

What is the molecular formula and weight of Complement factor D-IN-1?

The molecular formula of Complement factor D-IN-1 is C21H19BrN6O3 and its molar mass is 483.33 g/mol.

What is Complement factor D-IN-1 used for?

Known uses and roles of Complement factor D-IN-1 include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Complement factor D-IN-1 hazardous?

No GHS hazard classification for Complement factor D-IN-1 is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Complement factor D-IN-1?

Complement factor D-IN-1 is usually classified under HS code 293339 (Compounds containing an unfused pyridine ring (whether or not hydrogenated) in the…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Complement factor D-IN-1?

Post a free request on CompoundList and suppliers of Complement factor D-IN-1 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Complement factor D-IN-1?

Suppliers quote Complement factor D-IN-1 on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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