C797-1087 Screening compound: N-[(3-chlorophenyl)methyl]-4-[(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]benzamide

C797-1087 Screening compound: N-[(3-chlorophenyl)methyl]-4-[(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]benzamide
C797-1087 Screening compound: N-[(3-chlorophenyl)methyl]-4-[(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C797-1087
N-[(3-chlorophenyl)methyl]-4-[(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)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

C797-1087

Molecular Formula

C29H25ClN4OS (C29 H25 ClN4 OS)

Compound Name

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

IUPAC name

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

SMILES

Cc1cccc(CSc2nc(ccnc3)c3n2Cc(cc2)ccc2C(NCc2cccc(Cl)c2)=O)c1

InChI

InChI=1S/C29H25ClN4OS/c1-20-4-2-6-23(14-20)19-36-29-33-26-12-13-31-17-27(26)34(29)18-21-8-10-24(11-9-21)28(35)32-16-22-5-3-7-25(30)15-22/h2-15,17H,16,18-19H2,1H3,(H,32,35)

InChI Key

HKPKEEDSDGCQBU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14798545

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

513.06

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

6.682

Distribution Coefficient, logD

6.679

Water Solubility, LogSw

-6.28

Polar Surface Area

44.409

Acid Dissociation Constant (pKa)

11.60

Base Dissociation Constant (pKb)

5.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.80

References: we are preparing a list of scientific research reports with C797-1087 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of C797-1087 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C797-1087
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C797-1087
  • 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 C797-1087 available by request