F432-0432 Screening compound: N-{6-[(2-chlorophenyl)sulfanyl]-1,3-dimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-5-yl}-3-cyanobenzene-1-sulfonamide

F432-0432 Screening compound: N-{6-[(2-chlorophenyl)sulfanyl]-1,3-dimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-5-yl}-3-cyanobenzene-1-sulfonamide
F432-0432 Screening compound: N-{6-[(2-chlorophenyl)sulfanyl]-1,3-dimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-5-yl}-3-cyanobenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F432-0432
N-{6-[(2-chlorophenyl)sulfanyl]-1,3-dimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-5-yl}-3-cyanobenzene-1-sulfonamide

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

F432-0432

Molecular Formula

C22H17ClN4O3S2 (C22 H17 ClN4 O3 S2)

Compound Name

N-{6-[(2-chlorophenyl)sulfanyl]-1,3-dimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-5-yl}-3-cyanobenzene-1-sulfonamide

IUPAC name

N-{6-[(2-chlorophenyl)sulfanyl]-13-dimethyl-2-oxo-23-dihydro-1H-13-benzodiazol-5-yl}-3-cyanobenzene-1-sulfonamide

SMILES

CN(c(c(N1C)c2)cc(NS(c3cc(C#N)ccc3)(=O)=O)c2Sc(cccc2)c2Cl)C1=O

InChI

InChI=1S/C22H17ClN4O3S2/c1-26-18-11-17(25-32(29,30)15-7-5-6-14(10-15)13-24)21(12-19(18)27(2)22(26)28)31-20-9-4-3-8-16(20)23/h3-12,25H,1-2H3

InChI Key

UPUNYUBBNXBSHZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27128519

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

484.99

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.531

Distribution Coefficient, logD

4.445

Water Solubility, LogSw

-4.59

Polar Surface Area

74.660

Acid Dissociation Constant (pKa)

8.06

Base Dissociation Constant (pKb)

-2.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

F432-0432 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with F432-0432 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F432-0432?
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What is the minimum amount of F432-0432 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F432-0432
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F432-0432
  • 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 F432-0432 available by request