1227-0089 Screening compound: 2-chloro-5-(diethylsulfamoyl)benzoic acid

1227-0089 Screening compound: 2-chloro-5-(diethylsulfamoyl)benzoic acid
1227-0089 Screening compound: 2-chloro-5-(diethylsulfamoyl)benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 1227-0089
2-chloro-5-(diethylsulfamoyl)benzoic acid

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

1227-0089

Molecular Formula

C11H14ClNO4S (C11 H14 ClNO4 S)

Compound Name

2-chloro-5-(diethylsulfamoyl)benzoic acid

IUPAC name

2-chloro-5-(diethylsulfamoyl)benzoic acid

SMILES

CCN(CC)S(c(cc1)cc(C(O)=O)c1Cl)(=O)=O

InChI

InChI=1S/C11H14ClNO4S/c1-3-13(4-2)18(16,17)8-5-6-10(12)9(7-8)11(14)15/h5-7H,3-4H2,1-2H3,(H,14,15)

InChI Key

IWLIXVSPGIDTAZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00625734

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

291.76

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.429

Distribution Coefficient, logD

-3.194

Water Solubility, LogSw

-3.07

Polar Surface Area

59.743

Acid Dissociation Constant (pKa)

1.78

Base Dissociation Constant (pKb)

-5.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

1227-0089 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Agro:
  • Agro
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 1227-0089 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1227-0089?
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What is the minimum amount of 1227-0089 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1227-0089
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1227-0089
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 1227-0089 available by request