C797-0678 Screening compound: N-[(4-ethylphenyl)methyl]-4-[({3-[(2-fluorophenyl)methyl]-3H-imidazo[4,5-c]pyridin-2-yl}sulfanyl)methyl]benzamide

C797-0678 Screening compound: N-[(4-ethylphenyl)methyl]-4-[({3-[(2-fluorophenyl)methyl]-3H-imidazo[4,5-c]pyridin-2-yl}sulfanyl)methyl]benzamide
C797-0678 Screening compound: N-[(4-ethylphenyl)methyl]-4-[({3-[(2-fluorophenyl)methyl]-3H-imidazo[4,5-c]pyridin-2-yl}sulfanyl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C797-0678
N-[(4-ethylphenyl)methyl]-4-[({3-[(2-fluorophenyl)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

C797-0678

Molecular Formula

C30H27FN4OS (C30 H27 FN4 OS)

Compound Name

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

IUPAC name

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

SMILES

CCc1ccc(CNC(c2ccc(CSc3nc(ccnc4)c4n3Cc(cccc3)c3F)cc2)=O)cc1

InChI

InChI=1S/C30H27FN4OS/c1-2-21-7-9-22(10-8-21)17-33-29(36)24-13-11-23(12-14-24)20-37-30-34-27-15-16-32-18-28(27)35(30)19-25-5-3-4-6-26(25)31/h3-16,18H,2,17,19-20H2,1H3,(H,33,36)

InChI Key

MGLRTIYRTYJOGQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14798275

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

510.64

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

6.269

Distribution Coefficient, logD

6.268

Water Solubility, LogSw

-5.36

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

16.70

References: we are preparing a list of scientific research reports with C797-0678 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C797-0678?
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What is the minimum amount of C797-0678 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C797-0678
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C797-0678
  • 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 C797-0678 available by request