C875-0141 Screening compound: N-(4-bromo-2-fluorophenyl)-2-(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)acetamide

C875-0141 Screening compound: N-(4-bromo-2-fluorophenyl)-2-(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)acetamide
C875-0141 Screening compound: N-(4-bromo-2-fluorophenyl)-2-(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C875-0141
N-(4-bromo-2-fluorophenyl)-2-(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)acetamide

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

C875-0141

Molecular Formula

C22H18BrFN4OS (C22 H18 BrFN4 OS)

Compound Name

N-(4-bromo-2-fluorophenyl)-2-(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)acetamide

IUPAC name

N-(4-bromo-2-fluorophenyl)-2-(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[45-c]pyridin-3-yl)acetamide

SMILES

Cc1cccc(CSc2nc(ccnc3)c3n2CC(Nc(ccc(Br)c2)c2F)=O)c1

InChI

InChI=1S/C22H18BrFN4OS/c1-14-3-2-4-15(9-14)13-30-22-27-19-7-8-25-11-20(19)28(22)12-21(29)26-18-6-5-16(23)10-17(18)24/h2-11H,12-13H2,1H3,(H,26,29)

InChI Key

CKERPMIGFKPOAK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14802223

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

485.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.756

Distribution Coefficient, logD

5.723

Water Solubility, LogSw

-5.18

Polar Surface Area

42.447

Acid Dissociation Constant (pKa)

8.74

Base Dissociation Constant (pKb)

5.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

C875-0141 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with C875-0141 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C875-0141?
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What is the minimum amount of C875-0141 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C875-0141
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C875-0141
  • 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 C875-0141 available by request