C176-0433 Screening compound: 4-(4-chlorobenzenesulfonyl)-5-{[(2-chlorophenyl)methyl]sulfanyl}-2-(furan-2-yl)-1,3-oxazole

C176-0433 Screening compound: 4-(4-chlorobenzenesulfonyl)-5-{[(2-chlorophenyl)methyl]sulfanyl}-2-(furan-2-yl)-1,3-oxazole
C176-0433 Screening compound: 4-(4-chlorobenzenesulfonyl)-5-{[(2-chlorophenyl)methyl]sulfanyl}-2-(furan-2-yl)-1,3-oxazole alternative view

Chemical Structure Depiction of ChemDiv screening compound C176-0433
4-(4-chlorobenzenesulfonyl)-5-{[(2-chlorophenyl)methyl]sulfanyl}-2-(furan-2-yl)-1,3-oxazole

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

C176-0433

Molecular Formula

C20H13Cl2NO4S2 (C20 H13 Cl2 NO4 S2)

Compound Name

4-(4-chlorobenzenesulfonyl)-5-{[(2-chlorophenyl)methyl]sulfanyl}-2-(furan-2-yl)-1,3-oxazole

IUPAC name

4-(4-chlorobenzenesulfonyl)-5-{[(2-chlorophenyl)methyl]sulfanyl}-2-(furan-2-yl)-13-oxazole

SMILES

O=S(c(nc(-c1ccco1)o1)c1SCc(cccc1)c1Cl)(c(cc1)ccc1Cl)=O

InChI

InChI=1S/C20H13Cl2NO4S2/c21-14-7-9-15(10-8-14)29(24,25)19-20(27-18(23-19)17-6-3-11-26-17)28-12-13-4-1-2-5-16(13)22/h1-11H,12H2

InChI Key

RGIAUQDCULIYNC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04459795

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.36

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.126

Distribution Coefficient, logD

6.126

Water Solubility, LogSw

-6.24

Polar Surface Area

56.247

Acid Dissociation Constant (pKa)

28.37

Base Dissociation Constant (pKb)

-8.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

C176-0433 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Antiviral Annotated Library (21441 compounds)

Human Kinases Annotated Library (2415 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C176-0433 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C176-0433?
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What is the minimum amount of C176-0433 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C176-0433
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C176-0433
  • 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 C176-0433 available by request