C875-0729 Screening compound: N-(3-fluorophenyl)-2-(2-{[(2-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)acetamide

C875-0729 Screening compound: N-(3-fluorophenyl)-2-(2-{[(2-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)acetamide
C875-0729 Screening compound: N-(3-fluorophenyl)-2-(2-{[(2-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C875-0729
N-(3-fluorophenyl)-2-(2-{[(2-fluorophenyl)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

C875-0729

Molecular Formula

C21H16F2N4OS (C21 H16 F2 N4 OS)

Compound Name

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

IUPAC name

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

SMILES

O=C(Cn1c(SCc(cccc2)c2F)nc2c1cncc2)Nc1cc(F)ccc1

InChI

InChI=1S/C21H16F2N4OS/c22-15-5-3-6-16(10-15)25-20(28)12-27-19-11-24-9-8-18(19)26-21(27)29-13-14-4-1-2-7-17(14)23/h1-11H,12-13H2,(H,25,28)

InChI Key

LZHMWEKJQXIXIP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14802550

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.45

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

4.869

Distribution Coefficient, logD

4.855

Water Solubility, LogSw

-4.70

Polar Surface Area

43.145

Acid Dissociation Constant (pKa)

10.55

Base Dissociation Constant (pKb)

5.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

C875-0729 in Drug Discovery

Included in Screening Libraries

Nucleic Acid Ligands (8311 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with C875-0729 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C875-0729?
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What is the minimum amount of C875-0729 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C875-0729
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C875-0729
  • 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 C875-0729 available by request