V009-7536 Screening compound: 2,2-dimethyl-N-(4-{4-oxo-3-[4-(trifluoromethyl)phenyl]-1,3-thiazolidin-2-yl}phenyl)propanamide

V009-7536 Screening compound: 2,2-dimethyl-N-(4-{4-oxo-3-[4-(trifluoromethyl)phenyl]-1,3-thiazolidin-2-yl}phenyl)propanamide
V009-7536 Screening compound: 2,2-dimethyl-N-(4-{4-oxo-3-[4-(trifluoromethyl)phenyl]-1,3-thiazolidin-2-yl}phenyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-7536
2,2-dimethyl-N-(4-{4-oxo-3-[4-(trifluoromethyl)phenyl]-1,3-thiazolidin-2-yl}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

V009-7536

Molecular Formula

C21H21F3N2O2S (C21 H21 F3 N2 O2 S)

Compound Name

2,2-dimethyl-N-(4-{4-oxo-3-[4-(trifluoromethyl)phenyl]-1,3-thiazolidin-2-yl}phenyl)propanamide

IUPAC name

22-dimethyl-N-(4-{4-oxo-3-[4-(trifluoromethyl)phenyl]-13-thiazolidin-2-yl}phenyl)propanamide

SMILES

CC(C)(C)C(Nc1ccc(C(N2c3ccc(C(F)(F)F)cc3)SCC2=O)cc1)=O

InChI

InChI=1S/C21H21F3N2O2S/c1-20(2,3)19(28)25-15-8-4-13(5-9-15)18-26(17(27)12-29-18)16-10-6-14(7-11-16)21(22,23)24/h4-11,18H,12H2,1-3H3,(H,25,28)/t18-/m0/s1

InChI Key

STVHELYKFHKHPN-SFHVURJKSA-N

MDL Number (MFCD)

MFCD19860174

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.552

Distribution Coefficient, logD

4.552

Water Solubility, LogSw

-4.32

Polar Surface Area

39.496

Acid Dissociation Constant (pKa)

12.09

Base Dissociation Constant (pKb)

1.32

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

V009-7536 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with V009-7536 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-7536?
Check Price and Availability of V009-7536, 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 V009-7536 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-7536
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-7536
  • 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 V009-7536 available by request