V001-9911 Screening compound: 4-methyl-N-{3-[3-(3-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl}-3-nitrobenzamide

V001-9911 Screening compound: 4-methyl-N-{3-[3-(3-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl}-3-nitrobenzamide
V001-9911 Screening compound: 4-methyl-N-{3-[3-(3-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl}-3-nitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-9911
4-methyl-N-{3-[3-(3-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl}-3-nitrobenzamide

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

V001-9911

Molecular Formula

C24H21N3O4S (C24 H21 N3 O4 S)

Compound Name

4-methyl-N-{3-[3-(3-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl}-3-nitrobenzamide

IUPAC name

4-methyl-N-{3-[3-(3-methylphenyl)-4-oxo-13-thiazolidin-2-yl]phenyl}-3-nitrobenzamide

SMILES

Cc1cccc(N(C(c2cc(NC(c3cc([N+]([O-])=O)c(C)cc3)=O)ccc2)SC2)C2=O)c1

InChI

InChI=1S/C24H21N3O4S/c1-15-5-3-8-20(11-15)26-22(28)14-32-24(26)18-6-4-7-19(12-18)25-23(29)17-10-9-16(2)21(13-17)27(30)31/h3-13,24H,14H2,1-2H3,(H,25,29)/t24-/m0/s1

InChI Key

LJZQNSQPCMAATC-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD19854956

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.51

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.041

Distribution Coefficient, logD

5.039

Water Solubility, LogSw

-4.76

Polar Surface Area

72.305

Acid Dissociation Constant (pKa)

9.62

Base Dissociation Constant (pKb)

-2.67

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.70

V001-9911 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 V001-9911 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-9911?
Check Price and Availability of V001-9911, 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 V001-9911 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-9911
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-9911
  • 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 V001-9911 available by request