V009-1002 Screening compound: 3,3-dimethyl-N-(3-{4-oxo-3-[4-(trifluoromethyl)phenyl]-1,3-thiazolidin-2-yl}phenyl)butanamide

V009-1002 Screening compound: 3,3-dimethyl-N-(3-{4-oxo-3-[4-(trifluoromethyl)phenyl]-1,3-thiazolidin-2-yl}phenyl)butanamide
V009-1002 Screening compound: 3,3-dimethyl-N-(3-{4-oxo-3-[4-(trifluoromethyl)phenyl]-1,3-thiazolidin-2-yl}phenyl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-1002
3,3-dimethyl-N-(3-{4-oxo-3-[4-(trifluoromethyl)phenyl]-1,3-thiazolidin-2-yl}phenyl)butanamide

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

V009-1002

Molecular Formula

C22H23F3N2O2S (C22 H23 F3 N2 O2 S)

Compound Name

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

IUPAC name

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

SMILES

CC(C)(C)CC(Nc1cccc(C(N2c3ccc(C(F)(F)F)cc3)SCC2=O)c1)=O

InChI

InChI=1S/C22H23F3N2O2S/c1-21(2,3)12-18(28)26-16-6-4-5-14(11-16)20-27(19(29)13-30-20)17-9-7-15(8-10-17)22(23,24)25/h4-11,20H,12-13H2,1-3H3,(H,26,28)/t20-/m0/s1

InChI Key

LSURPXZVGJXGJN-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD19860218

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.284

Distribution Coefficient, logD

5.284

Water Solubility, LogSw

-5.26

Polar Surface Area

39.282

Acid Dissociation Constant (pKa)

11.78

Base Dissociation Constant (pKb)

3.14

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.40

V009-1002 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 V009-1002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-1002?
Check Price and Availability of V009-1002, 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 V009-1002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-1002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-1002
  • 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 V009-1002 available by request