V031-2494 Screening compound: 3-bromo-N-{3-[3-(3,4-dimethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl}benzamide

V031-2494 Screening compound: 3-bromo-N-{3-[3-(3,4-dimethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl}benzamide
V031-2494 Screening compound: 3-bromo-N-{3-[3-(3,4-dimethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V031-2494
3-bromo-N-{3-[3-(3,4-dimethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl}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

V031-2494

Molecular Formula

C24H21BrN2O2S (C24 H21 BrN2 O2 S)

Compound Name

3-bromo-N-{3-[3-(3,4-dimethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl}benzamide

IUPAC name

3-bromo-N-{3-[3-(34-dimethylphenyl)-4-oxo-13-thiazolidin-2-yl]phenyl}benzamide

SMILES

Cc(cc1)c(C)cc1N(C(c1cccc(NC(c2cccc(Br)c2)=O)c1)SC1)C1=O

InChI

InChI=1S/C24H21BrN2O2S/c1-15-9-10-21(11-16(15)2)27-22(28)14-30-24(27)18-6-4-8-20(13-18)26-23(29)17-5-3-7-19(25)12-17/h3-13,24H,14H2,1-2H3,(H,26,29)/t24-/m0/s1

InChI Key

LQIJXWHWVKYOHQ-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD19855273

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

481.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.176

Distribution Coefficient, logD

6.175

Water Solubility, LogSw

-5.49

Polar Surface Area

39.224

Acid Dissociation Constant (pKa)

9.96

Base Dissociation Constant (pKb)

-0.87

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.70

V031-2494 in Drug Discovery

Included in Screening Libraries

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with V031-2494 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V031-2494?
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What is the minimum amount of V031-2494 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V031-2494
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V031-2494
  • 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 V031-2494 available by request