C797-0879 Screening compound: 4-[({3-[(2-fluorophenyl)methyl]-3H-imidazo[4,5-c]pyridin-2-yl}sulfanyl)methyl]-N-[(3-methylphenyl)methyl]benzamide

C797-0879 Screening compound: 4-[({3-[(2-fluorophenyl)methyl]-3H-imidazo[4,5-c]pyridin-2-yl}sulfanyl)methyl]-N-[(3-methylphenyl)methyl]benzamide
C797-0879 Screening compound: 4-[({3-[(2-fluorophenyl)methyl]-3H-imidazo[4,5-c]pyridin-2-yl}sulfanyl)methyl]-N-[(3-methylphenyl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C797-0879
4-[({3-[(2-fluorophenyl)methyl]-3H-imidazo[4,5-c]pyridin-2-yl}sulfanyl)methyl]-N-[(3-methylphenyl)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

C797-0879

Molecular Formula

C29H25FN4OS (C29 H25 FN4 OS)

Compound Name

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

IUPAC name

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

SMILES

Cc1cccc(CNC(c2ccc(CSc3nc(ccnc4)c4n3Cc(cccc3)c3F)cc2)=O)c1

InChI

InChI=1S/C29H25FN4OS/c1-20-5-4-6-22(15-20)16-32-28(35)23-11-9-21(10-12-23)19-36-29-33-26-13-14-31-17-27(26)34(29)18-24-7-2-3-8-25(24)30/h2-15,17H,16,18-19H2,1H3,(H,32,35)

InChI Key

RBNQSWBMSMWRQT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14798420

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

496.61

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

6.027

Distribution Coefficient, logD

6.025

Water Solubility, LogSw

-5.33

Polar Surface Area

44.409

Acid Dissociation Constant (pKa)

11.60

Base Dissociation Constant (pKb)

5.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.80

References: we are preparing a list of scientific research reports with C797-0879 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of C797-0879 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C797-0879
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C797-0879
  • 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 C797-0879 available by request