C797-0768 Screening compound: N-benzyl-4-[({3-[(2-methylphenyl)methyl]-3H-imidazo[4,5-c]pyridin-2-yl}sulfanyl)methyl]benzamide

C797-0768 Screening compound: N-benzyl-4-[({3-[(2-methylphenyl)methyl]-3H-imidazo[4,5-c]pyridin-2-yl}sulfanyl)methyl]benzamide
C797-0768 Screening compound: N-benzyl-4-[({3-[(2-methylphenyl)methyl]-3H-imidazo[4,5-c]pyridin-2-yl}sulfanyl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C797-0768
N-benzyl-4-[({3-[(2-methylphenyl)methyl]-3H-imidazo[4,5-c]pyridin-2-yl}sulfanyl)methyl]benzamide

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

C797-0768

Molecular Formula

C29H26N4OS (C29 H26 N4 OS)

Compound Name

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

IUPAC name

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

SMILES

Cc1c(Cn2c(SCc(cc3)ccc3C(NCc3ccccc3)=O)nc3c2cncc3)cccc1

InChI

InChI=1S/C29H26N4OS/c1-21-7-5-6-10-25(21)19-33-27-18-30-16-15-26(27)32-29(33)35-20-23-11-13-24(14-12-23)28(34)31-17-22-8-3-2-4-9-22/h2-16,18H,17,19-20H2,1H3,(H,31,34)

InChI Key

XSNOQNVXYIXSCN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14798349

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.62

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.817

Distribution Coefficient, logD

5.800

Water Solubility, LogSw

-5.27

Polar Surface Area

44.409

Acid Dissociation Constant (pKa)

11.60

Base Dissociation Constant (pKb)

6.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.80

C797-0768 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with C797-0768 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C797-0768?
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What is the minimum amount of C797-0768 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C797-0768
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C797-0768
  • 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 C797-0768 available by request