V003-3879 Screening compound: N-{4-[3-(4-tert-butylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl}-4-methoxybenzamide

V003-3879 Screening compound: N-{4-[3-(4-tert-butylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl}-4-methoxybenzamide
V003-3879 Screening compound: N-{4-[3-(4-tert-butylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl}-4-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-3879
N-{4-[3-(4-tert-butylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl}-4-methoxybenzamide

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

V003-3879

Molecular Formula

C27H28N2O3S (C27 H28 N2 O3 S)

Compound Name

N-{4-[3-(4-tert-butylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl}-4-methoxybenzamide

IUPAC name

N-{4-[3-(4-tert-butylphenyl)-4-oxo-13-thiazolidin-2-yl]phenyl}-4-methoxybenzamide

SMILES

CC(C)(C)c(cc1)ccc1N(C(c(cc1)ccc1NC(c(cc1)ccc1OC)=O)SC1)C1=O

InChI

InChI=1S/C27H28N2O3S/c1-27(2,3)20-9-13-22(14-10-20)29-24(30)17-33-26(29)19-5-11-21(12-6-19)28-25(31)18-7-15-23(32-4)16-8-18/h5-16,26H,17H2,1-4H3,(H,28,31)/t26-/m0/s1

InChI Key

VWKRDGZHIWNIHO-SANMLTNESA-N

MDL Number (MFCD)

MFCD19861445

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.6

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.865

Distribution Coefficient, logD

5.865

Water Solubility, LogSw

-5.55

Polar Surface Area

46.768

Acid Dissociation Constant (pKa)

11.39

Base Dissociation Constant (pKb)

-1.13

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.90

V003-3879 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 V003-3879 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-3879?
Check Price and Availability of V003-3879, 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 V003-3879 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-3879
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-3879
  • 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 V003-3879 available by request