C797-1006 Screening compound: N-cyclohexyl-4-[(2-{[(3-methoxyphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]benzamide

C797-1006 Screening compound: N-cyclohexyl-4-[(2-{[(3-methoxyphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]benzamide
C797-1006 Screening compound: N-cyclohexyl-4-[(2-{[(3-methoxyphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C797-1006
N-cyclohexyl-4-[(2-{[(3-methoxyphenyl)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

C797-1006

Molecular Formula

C28H30N4O2S (C28 H30 N4 O2 S)

Compound Name

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

IUPAC name

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

SMILES

COc1cccc(CSc2nc(ccnc3)c3n2Cc(cc2)ccc2C(NC2CCCCC2)=O)c1

InChI

InChI=1S/C28H30N4O2S/c1-34-24-9-5-6-21(16-24)19-35-28-31-25-14-15-29-17-26(25)32(28)18-20-10-12-22(13-11-20)27(33)30-23-7-3-2-4-8-23/h5-6,9-17,23H,2-4,7-8,18-19H2,1H3,(H,30,33)

InChI Key

JAZVPKFXVSCPNL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14798484

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.64

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.726

Distribution Coefficient, logD

5.723

Water Solubility, LogSw

-5.08

Polar Surface Area

51.678

Acid Dissociation Constant (pKa)

14.07

Base Dissociation Constant (pKb)

5.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.10

C797-1006 in Drug Discovery

Included in Screening Libraries

GABA Library (7115 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Eye
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C797-1006 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C797-1006?
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What is the minimum amount of C797-1006 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C797-1006
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C797-1006
  • 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 C797-1006 available by request