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Screening compounds

Orb1692305

Also known as 5-Chloro-N-[2-(4-hydroxysulfamoyl-phenyl)-ethyl]-2-methoxy-benzamide, 5-chloro-N-[2-[4-(hydroxysulfamoyl)phenyl]ethyl]-2-methoxybenzamide

CAS 2112809-98-8Formula C16H17ClN2O5SMolar mass 384.84 g/mol
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Orb1692305 chemical structure, C16H17ClN2O5S, CAS 2112809-98-8
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
2112809-98-8
Formula
C16H17ClN2O5S
Molar mass
384.84 g/mol
HS code
293590
Category
Screening compounds

What is Orb1692305?

Plain description, key identifiers and synonyms

Orb1692305 is a chemical substance with the molecular formula C16H17ClN2O5S and a molar mass of 384.84 g/mol. Its CAS registry number is 2112809-98-8. The IUPAC name is 5-chloro-N-[2-[4-(hydroxysulfamoyl)phenyl]ethyl]-2-methoxybenzamide.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
5-chloro-N-[2-[4-(hydroxysulfamoyl)phenyl]ethyl]-2-methoxybenzamide
CAS number
2112809-98-8
Molecular formula
C16H17ClN2O5S
InChIKey
KQRQPMUPYDOTCA-UHFFFAOYSA-N
InChI
InChI=1S/C16H17ClN2O5S/c1-24-15-7-4-12(17)10-14(15)16(20)18-9-8-11-2-5-13(6-3-11)25(22,23)19-21/h2-7,10,19,21H,8-9H2,1H3,(H,18,20)
SMILES (canonical and isomeric)
COC1=C(C=C(C=C1)Cl)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)NO

Synonyms

  • 5-Chloro-N-[2-(4-hydroxysulfamoyl-phenyl)-ethyl]-2-methoxy-benzamide
  • 5-chloro-N-[2-[4-(hydroxysulfamoyl)phenyl]ethyl]-2-methoxybenzamide

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
384.84 g/molcalc.
Exact mass
384.0547 Dacalc.
LogP (octanol/water)
1.99calc.
Topological polar surface area
104.7 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
5calc.
Rotatable bonds
7calc.
Heavy atoms
25calc.
Rings
2calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.19calc.
Formal charge
0calc.
Stereocentres
0calc.
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(NCCc1ccccc1)c1ccccc1

O=C(NCCc1ccccc1)c1ccccc1

2 rings, 17 atoms, the N-Phenethylbenzamide ring system.

1,065 other chemicals share 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.

Orb1692305 suppliers

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Orb1692305 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

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 Orb1692305 is traded under.

HS 2935.90Indicative HS code

Sulphonamides, other

World exports in 2024
$5.64B
−11.0% vs 2023, imports $8.56B
2019 to 2024
Top exporters
  1. Ireland43.1%
  2. China12.0%
  3. India * partner reported9.5%
Top importers
  1. United States23.6%
  2. Slovenia19.1%
  3. Spain11.7%

* Partner reported figures, a lower bound.

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

The HS code shown for Orb1692305 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Orb1692305, based on the data on this page

What is Orb1692305?

Orb1692305 is a chemical substance with the molecular formula C16H17ClN2O5S and a molar mass of 384.84 g/mol. Its CAS registry number is 2112809-98-8. The IUPAC name is 5-chloro-N-[2-[4-(hydroxysulfamoyl)phenyl]ethyl]-2-methoxybenzamide.

What is the CAS number of Orb1692305?

The CAS registry number of Orb1692305 is 2112809-98-8.

What is the molecular formula and weight of Orb1692305?

The molecular formula of Orb1692305 is C16H17ClN2O5S and its molar mass is 384.84 g/mol.

What is Orb1692305 used for?

Known uses and roles of Orb1692305 include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Orb1692305 hazardous?

No GHS hazard classification for Orb1692305 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 Orb1692305?

Orb1692305 is usually classified under HS code 293590 (Sulphonamides, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Orb1692305?

Post a free request on CompoundList and suppliers of Orb1692305 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Orb1692305?

Suppliers quote Orb1692305 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 Orb1692305

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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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