F154-0604 Screening compound: 4-[(2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]-N-[(furan-2-yl)methyl]-N-methylbenzamide

F154-0604 Screening compound: 4-[(2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]-N-[(furan-2-yl)methyl]-N-methylbenzamide
F154-0604 Screening compound: 4-[(2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]-N-[(furan-2-yl)methyl]-N-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F154-0604
4-[(2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]-N-[(furan-2-yl)methyl]-N-methylbenzamide

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

F154-0604

Molecular Formula

C27H22ClFN4O2S (C27 H22 ClFN4 O2 S)

Compound Name

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

IUPAC name

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

SMILES

CN(Cc1ccco1)C(c1ccc(Cn2c(SCc(ccc(F)c3)c3Cl)nc3c2cncc3)cc1)=O

InChI

InChI=1S/C27H22ClFN4O2S/c1-32(16-22-3-2-12-35-22)26(34)19-6-4-18(5-7-19)15-33-25-14-30-11-10-24(25)31-27(33)36-17-20-8-9-21(29)13-23(20)28/h2-14H,15-17H2,1H3

InChI Key

YYOSMPGIDDPDCL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14943686

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

521.01

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.668

Distribution Coefficient, logD

5.665

Water Solubility, LogSw

-6.02

Polar Surface Area

43.894

Acid Dissociation Constant (pKa)

22.95

Base Dissociation Constant (pKb)

5.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.80

F154-0604 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F154-0604 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F154-0604?
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What is the minimum amount of F154-0604 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F154-0604
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F154-0604
  • 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 F154-0604 available by request