V031-0195 Screening compound: 3-[6-(1-benzothiophen-2-yl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-[3-(trifluoromethyl)phenyl]propanamide

V031-0195 Screening compound: 3-[6-(1-benzothiophen-2-yl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-[3-(trifluoromethyl)phenyl]propanamide
V031-0195 Screening compound: 3-[6-(1-benzothiophen-2-yl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-[3-(trifluoromethyl)phenyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V031-0195
3-[6-(1-benzothiophen-2-yl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-[3-(trifluoromethyl)phenyl]propanamide

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

V031-0195

Molecular Formula

C31H21ClF3N3OS (C31 H21 ClF3 N3 OS)

Compound Name

3-[6-(1-benzothiophen-2-yl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-[3-(trifluoromethyl)phenyl]propanamide

IUPAC name

3-[6-(1-benzothiophen-2-yl)-2-(4-chlorophenyl)imidazo[12-a]pyridin-3-yl]-N-[3-(trifluoromethyl)phenyl]propanamide

SMILES

O=C(CCc1c(-c(cc2)ccc2Cl)nc(cc2)n1cc2-c1cc(cccc2)c2s1)Nc1cc(C(F)(F)F)ccc1

InChI

InChI=1S/C31H21ClF3N3OS/c32-23-11-8-19(9-12-23)30-25(13-15-29(39)36-24-6-3-5-22(17-24)31(33,34)35)38-18-21(10-14-28(38)37-30)27-16-20-4-1-2-7-26(20)40-27/h1-12,14,16-18H,13,15H2,(H,36,39)

InChI Key

YUHYXEATSOZXMD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20494797

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

576.04

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

8.711

Distribution Coefficient, logD

8.707

Water Solubility, LogSw

-7.00

Polar Surface Area

31.851

Acid Dissociation Constant (pKa)

9.84

Base Dissociation Constant (pKb)

5.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.70

V031-0195 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with V031-0195 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V031-0195?
Check Price and Availability of V031-0195, 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 V031-0195 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V031-0195
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V031-0195
  • 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 V031-0195 available by request