V005-6866 Screening compound: 4-butyl-N-{4-[3-(2-ethoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl}benzamide

V005-6866 Screening compound: 4-butyl-N-{4-[3-(2-ethoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl}benzamide
V005-6866 Screening compound: 4-butyl-N-{4-[3-(2-ethoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V005-6866
4-butyl-N-{4-[3-(2-ethoxyphenyl)-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

V005-6866

Molecular Formula

C28H30N2O3S (C28 H30 N2 O3 S)

Compound Name

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

IUPAC name

4-butyl-N-{4-[3-(2-ethoxyphenyl)-4-oxo-13-thiazolidin-2-yl]phenyl}benzamide

SMILES

CCCCc(cc1)ccc1C(Nc1ccc(C(N2c(cccc3)c3OCC)SCC2=O)cc1)=O

InChI

InChI=1S/C28H30N2O3S/c1-3-5-8-20-11-13-21(14-12-20)27(32)29-23-17-15-22(16-18-23)28-30(26(31)19-34-28)24-9-6-7-10-25(24)33-4-2/h6-7,9-18,28H,3-5,8,19H2,1-2H3,(H,29,32)/t28-/m0/s1

InChI Key

LGNFKKLTHLIOJH-NDEPHWFRSA-N

MDL Number (MFCD)

MFCD19858346

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.62

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.426

Distribution Coefficient, logD

6.426

Water Solubility, LogSw

-5.74

Polar Surface Area

46.133

Acid Dissociation Constant (pKa)

10.99

Base Dissociation Constant (pKb)

-1.40

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.60

V005-6866 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 V005-6866 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V005-6866?
Check Price and Availability of V005-6866, 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 V005-6866 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V005-6866
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V005-6866
  • 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 V005-6866 available by request