C797-1050 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[(2-{[(4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]benzamide

C797-1050 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[(2-{[(4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]benzamide
C797-1050 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[(2-{[(4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C797-1050
N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[(2-{[(4-fluorophenyl)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

C797-1050

Molecular Formula

C29H29FN4OS (C29 H29 FN4 OS)

Compound Name

N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[(2-{[(4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]benzamide

IUPAC name

N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[(2-{[(4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[45-c]pyridin-3-yl)methyl]benzamide

SMILES

O=C(c1ccc(Cn2c(SCc(cc3)ccc3F)nc3c2cncc3)cc1)NCCC1=CCCCC1

InChI

InChI=1S/C29H29FN4OS/c30-25-12-8-23(9-13-25)20-36-29-33-26-15-16-31-18-27(26)34(29)19-22-6-10-24(11-7-22)28(35)32-17-14-21-4-2-1-3-5-21/h4,6-13,15-16,18H,1-3,5,14,17,19-20H2,(H,32,35)

InChI Key

FOIWFVPTVGVWPV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14798512

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

500.64

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

5.394

Distribution Coefficient, logD

5.391

Water Solubility, LogSw

-5.37

Polar Surface Area

44.442

Acid Dissociation Constant (pKa)

13.64

Base Dissociation Constant (pKb)

5.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.60

References: we are preparing a list of scientific research reports with C797-1050 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C797-1050?
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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C797-1050
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C797-1050
  • 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 C797-1050 available by request