C797-0419 Screening compound: 3-benzyl-2-{[(2-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridine

C797-0419 Screening compound: 3-benzyl-2-{[(2-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridine
C797-0419 Screening compound: 3-benzyl-2-{[(2-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound C797-0419
3-benzyl-2-{[(2-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridine

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

C797-0419

Molecular Formula

C21H19N3S (C21 H19 N3 S)

Compound Name

3-benzyl-2-{[(2-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridine

IUPAC name

3-benzyl-2-{[(2-methylphenyl)methyl]sulfanyl}-3H-imidazo[45-c]pyridine

SMILES

Cc1c(CSc2nc(ccnc3)c3n2Cc2ccccc2)cccc1

InChI

InChI=1S/C21H19N3S/c1-16-7-5-6-10-18(16)15-25-21-23-19-11-12-22-13-20(19)24(21)14-17-8-3-2-4-9-17/h2-13H,14-15H2,1H3

InChI Key

HOOIHNGTRSZHSV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14798074

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.47

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.641

Distribution Coefficient, logD

5.624

Water Solubility, LogSw

-5.44

Polar Surface Area

19.995

Acid Dissociation Constant (pKa)

22.95

Base Dissociation Constant (pKb)

6.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

C797-0419 in Drug Discovery

Included in Screening Libraries

Nucleic Acid Ligands (8311 compounds)

Targeted Diversity Library (40567 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 C797-0419 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C797-0419?
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What is the minimum amount of C797-0419 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C797-0419
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C797-0419
  • 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 C797-0419 available by request