C697-0931 Screening compound: N-(2,4-difluorophenyl)-3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamido)propanamide

C697-0931 Screening compound: N-(2,4-difluorophenyl)-3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamido)propanamide
C697-0931 Screening compound: N-(2,4-difluorophenyl)-3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamido)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C697-0931
N-(2,4-difluorophenyl)-3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamido)propanamide

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

C697-0931

Molecular Formula

C17H15F2N3O5S (C17 H15 F2 N3 O5 S)

Compound Name

N-(2,4-difluorophenyl)-3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamido)propanamide

IUPAC name

N-(24-difluorophenyl)-3-(3-methyl-2-oxo-23-dihydro-13-benzoxazole-6-sulfonamido)propanamide

SMILES

CN(c(ccc(S(NCCC(Nc(ccc(F)c1)c1F)=O)(=O)=O)c1)c1O1)C1=O

InChI

InChI=1S/C17H15F2N3O5S/c1-22-14-5-3-11(9-15(14)27-17(22)24)28(25,26)20-7-6-16(23)21-13-4-2-10(18)8-12(13)19/h2-5,8-9,20H,6-7H2,1H3,(H,21,23)

InChI Key

CFPWEHBCWHPZIA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14784026

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.39

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.672

Distribution Coefficient, logD

1.611

Water Solubility, LogSw

-2.65

Polar Surface Area

87.156

Acid Dissociation Constant (pKa)

8.22

Base Dissociation Constant (pKb)

-2.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.65

C697-0931 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

Antiviral Annotated Library (21441 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer

References: we are preparing a list of scientific research reports with C697-0931 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C697-0931?
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What is the minimum amount of C697-0931 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C697-0931
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C697-0931
  • 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 C697-0931 available by request