5196-0080 Screening compound: 3-[(4-chlorophenyl)sulfanyl]-2-phenylimidazo[1,2-a]pyrimidine

5196-0080 Screening compound: 3-[(4-chlorophenyl)sulfanyl]-2-phenylimidazo[1,2-a]pyrimidine
5196-0080 Screening compound: 3-[(4-chlorophenyl)sulfanyl]-2-phenylimidazo[1,2-a]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 5196-0080
3-[(4-chlorophenyl)sulfanyl]-2-phenylimidazo[1,2-a]pyrimidine

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

5196-0080

Molecular Formula

C18H12ClN3S (C18 H12 ClN3 S)

Compound Name

3-[(4-chlorophenyl)sulfanyl]-2-phenylimidazo[1,2-a]pyrimidine

IUPAC name

3-[(4-chlorophenyl)sulfanyl]-2-phenylimidazo[12-a]pyrimidine

SMILES

Clc(cc1)ccc1Sc1c(-c2ccccc2)nc2ncccn12

InChI

InChI=1S/C18H12ClN3S/c19-14-7-9-15(10-8-14)23-17-16(13-5-2-1-3-6-13)21-18-20-11-4-12-22(17)18/h1-12H

InChI Key

WSXRFRWTKGZGLB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01654751

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

337.83

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.597

Distribution Coefficient, logD

4.597

Water Solubility, LogSw

-5.08

Polar Surface Area

19.549

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

4.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

5196-0080 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands
  • PPI modulators

References: we are preparing a list of scientific research reports with 5196-0080 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5196-0080?
Check Price and Availability of 5196-0080, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 5196-0080 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5196-0080
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5196-0080
  • 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 5196-0080 available by request