C878-1748 Screening compound: 4-[(2-{[(4-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]-N-(2-phenylethyl)benzamide

C878-1748 Screening compound: 4-[(2-{[(4-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]-N-(2-phenylethyl)benzamide
C878-1748 Screening compound: 4-[(2-{[(4-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]-N-(2-phenylethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C878-1748
4-[(2-{[(4-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]-N-(2-phenylethyl)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

C878-1748

Molecular Formula

C30H28N4OS (C30 H28 N4 OS)

Compound Name

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

IUPAC name

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

SMILES

Cc1ccc(CSc2nc(ccnc3)c3n2Cc(cc2)ccc2C(NCCc2ccccc2)=O)cc1

InChI

InChI=1S/C30H28N4OS/c1-22-7-9-25(10-8-22)21-36-30-33-27-16-17-31-19-28(27)34(30)20-24-11-13-26(14-12-24)29(35)32-18-15-23-5-3-2-4-6-23/h2-14,16-17,19H,15,18,20-21H2,1H3,(H,32,35)

InChI Key

GVTBTNMIMATXJD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14802999

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

492.64

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.418

Distribution Coefficient, logD

5.415

Water Solubility, LogSw

-5.09

Polar Surface Area

44.250

Acid Dissociation Constant (pKa)

12.97

Base Dissociation Constant (pKb)

5.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

C878-1748 in Drug Discovery

Included in Screening Libraries

GABA Library (7115 compounds)

PD-1/L1 Library (498 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Eye
  • Cancer
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
Targets:
  • GPCR
  • Ion Channels
  • Others
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C878-1748 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C878-1748?
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What is the minimum amount of C878-1748 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C878-1748
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C878-1748
  • 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 C878-1748 available by request