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Orb2566159

Also known as US11753373, Compound D-3-a

CAS 2755957-14-1Formula C24H34F3N5O4Molar mass 513.56 g/mol
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Orb2566159 chemical structure, C24H34F3N5O4, CAS 2755957-14-1
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
2755957-14-1
Formula
C24H34F3N5O4
Molar mass
513.56 g/mol
HS code
293339
Category
Peptides

What is Orb2566159?

Plain description, key identifiers and synonyms

Orb2566159 is a chemical substance with the molecular formula C24H34F3N5O4 and a molar mass of 513.56 g/mol. Its CAS registry number is 2755957-14-1. The IUPAC name is (1R,2S,5S)-N-[(1S)-1-cyano-2-[(3S)-2-oxopiperidin-3-yl]ethyl]-3-[(2S)-3,3-dimethyl-2-[(2,2,2-trifluoroacetyl)amino]butanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(1R,2S,5S)-N-[(1S)-1-cyano-2-[(3S)-2-oxopiperidin-3-yl]ethyl]-3-[(2S)-3,3-dimethyl-2-[(2,2,2-trifluoroacetyl)amino]butanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide
CAS number
2755957-14-1
Molecular formula
C24H34F3N5O4
InChIKey
DGVNIEAIBBZBMO-KBCNZALWSA-N
InChI
InChI=1S/C24H34F3N5O4/c1-22(2,3)17(31-21(36)24(25,26)27)20(35)32-11-14-15(23(14,4)5)16(32)19(34)30-13(10-28)9-12-7-6-8-29-18(12)33/h12-17H,6-9,11H2,1-5H3,(H,29,33)(H,30,34)(H,31,36)/t12-,13-,14-,15-,16-,17+/m0/s1
Canonical SMILES
CC(C)(C)C(NC(=O)C(F)(F)F)C(=O)N1CC2C(C1C(=O)NC(C#N)CC1CCCNC1=O)C2(C)C
Isomeric SMILES
CC1([C@@H]2[C@H]1[C@H](N(C2)C(=O)[C@H](C(C)(C)C)NC(=O)C(F)(F)F)C(=O)N[C@@H](C[C@@H]3CCCNC3=O)C#N)C

Synonyms

  • US11753373, Compound D-3-a

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
513.56 g/molcalc.
Exact mass
513.2563 Dacalc.
LogP (octanol/water)
1.49calc.
Topological polar surface area
131.4 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
5calc.
Rotatable bonds
6calc.
Heavy atoms
36calc.
Rings
3calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.79calc.
Formal charge
0calc.
Stereocentres
6calc.
Lipinski rule of five
Passes (1 violation)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=C1NCCCC1CCNC(=O)C1NCC2CC21

O=C1NCCCC1CCNC(=O)C1NCC2CC21

3 rings, 18 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.

Orb2566159 suppliers

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Orb2566159 price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

Applications are not documented for this substance yet. Suppliers often describe uses on their product pages, linked in the suppliers list above.

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 Orb2566159 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 Orb2566159 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Orb2566159, based on the data on this page

What is Orb2566159?

Orb2566159 is a chemical substance with the molecular formula C24H34F3N5O4 and a molar mass of 513.56 g/mol. Its CAS registry number is 2755957-14-1.

What is the CAS number of Orb2566159?

The CAS registry number of Orb2566159 is 2755957-14-1.

What is the molecular formula and weight of Orb2566159?

The molecular formula of Orb2566159 is C24H34F3N5O4 and its molar mass is 513.56 g/mol.

Is Orb2566159 hazardous?

No GHS hazard classification for Orb2566159 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 Orb2566159?

Orb2566159 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 Orb2566159?

Post a free request on CompoundList and suppliers of Orb2566159 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Orb2566159?

Suppliers quote Orb2566159 on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle Orb2566159

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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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