V024-1319 Screening compound: 2-methyl-4-(2-phenylethyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-4H-thieno[3,2-b]pyrrole-5-carboxamide

V024-1319 Screening compound: 2-methyl-4-(2-phenylethyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-4H-thieno[3,2-b]pyrrole-5-carboxamide
V024-1319 Screening compound: 2-methyl-4-(2-phenylethyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-4H-thieno[3,2-b]pyrrole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-1319
2-methyl-4-(2-phenylethyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-4H-thieno[3,2-b]pyrrole-5-carboxamide

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

V024-1319

Molecular Formula

C24H21F3N2OS (C24 H21 F3 N2 OS)

Compound Name

2-methyl-4-(2-phenylethyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-4H-thieno[3,2-b]pyrrole-5-carboxamide

IUPAC name

2-methyl-4-(2-phenylethyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-4H-thieno[32-b]pyrrole-5-carboxamide

SMILES

Cc1cc(n(CCc2ccccc2)c(C(NCc2cc(C(F)(F)F)ccc2)=O)c2)c2s1

InChI

InChI=1S/C24H21F3N2OS/c1-16-12-20-22(31-16)14-21(29(20)11-10-17-6-3-2-4-7-17)23(30)28-15-18-8-5-9-19(13-18)24(25,26)27/h2-9,12-14H,10-11,15H2,1H3,(H,28,30)

InChI Key

NZLSHKQCHNHVIK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19910982

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.5

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.234

Distribution Coefficient, logD

6.234

Water Solubility, LogSw

-5.66

Polar Surface Area

26.103

Acid Dissociation Constant (pKa)

12.03

Base Dissociation Constant (pKb)

-1.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

V024-1319 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 V024-1319 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-1319?
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What is the minimum amount of V024-1319 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-1319
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-1319
  • 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 V024-1319 available by request