C875-0842 Screening compound: 4-[(2-{[(3-chlorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]-5-methyl-2-(3-methylphenyl)-1,3-oxazole

C875-0842 Screening compound: 4-[(2-{[(3-chlorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]-5-methyl-2-(3-methylphenyl)-1,3-oxazole
C875-0842 Screening compound: 4-[(2-{[(3-chlorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]-5-methyl-2-(3-methylphenyl)-1,3-oxazole alternative view

Chemical Structure Depiction of ChemDiv screening compound C875-0842
4-[(2-{[(3-chlorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]-5-methyl-2-(3-methylphenyl)-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

C875-0842

Molecular Formula

C25H21ClN4OS (C25 H21 ClN4 OS)

Compound Name

4-[(2-{[(3-chlorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]-5-methyl-2-(3-methylphenyl)-1,3-oxazole

IUPAC name

4-[(2-{[(3-chlorophenyl)methyl]sulfanyl}-3H-imidazo[45-c]pyridin-3-yl)methyl]-5-methyl-2-(3-methylphenyl)-13-oxazole

SMILES

Cc1c(Cn2c(SCc3cccc(Cl)c3)nc3c2cncc3)nc(-c2cc(C)ccc2)o1

InChI

InChI=1S/C25H21ClN4OS/c1-16-5-3-7-19(11-16)24-28-22(17(2)31-24)14-30-23-13-27-10-9-21(23)29-25(30)32-15-18-6-4-8-20(26)12-18/h3-13H,14-15H2,1-2H3

InChI Key

FUFVXOGXNHXWEG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14802613

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.99

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.332

Distribution Coefficient, logD

6.009

Water Solubility, LogSw

-6.32

Polar Surface Area

38.117

Acid Dissociation Constant (pKa)

23.82

Base Dissociation Constant (pKb)

7.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

C875-0842 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with C875-0842 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C875-0842?
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What is the minimum amount of C875-0842 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C875-0842
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C875-0842
  • 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 C875-0842 available by request