F154-0628 Screening compound: 4-[(2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]-N-[2-(thiophen-2-yl)ethyl]benzamide

F154-0628 Screening compound: 4-[(2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]-N-[2-(thiophen-2-yl)ethyl]benzamide
F154-0628 Screening compound: 4-[(2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]-N-[2-(thiophen-2-yl)ethyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F154-0628
4-[(2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]-N-[2-(thiophen-2-yl)ethyl]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

F154-0628

Molecular Formula

C27H22ClFN4OS2 (C27 H22 ClFN4 OS2)

Compound Name

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

IUPAC name

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

SMILES

O=C(c1ccc(Cn2c(SCc(ccc(F)c3)c3Cl)nc3c2cncc3)cc1)NCCc1cccs1

InChI

InChI=1S/C27H22ClFN4OS2/c28-23-14-21(29)8-7-20(23)17-36-27-32-24-10-11-30-15-25(24)33(27)16-18-3-5-19(6-4-18)26(34)31-12-9-22-2-1-13-35-22/h1-8,10-11,13-15H,9,12,16-17H2,(H,31,34)

InChI Key

LLDBCHZSNWIOAL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14943699

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

537.08

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

6.130

Distribution Coefficient, logD

6.127

Water Solubility, LogSw

-6.37

Polar Surface Area

45.268

Acid Dissociation Constant (pKa)

13.10

Base Dissociation Constant (pKb)

5.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.80

F154-0628 in Drug Discovery

Included in Screening Libraries

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

GABA Library (7115 compounds)

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Eye
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F154-0628 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F154-0628?
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What is the minimum amount of F154-0628 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F154-0628
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F154-0628
  • 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 F154-0628 available by request