V003-2246 Screening compound: N-{3-[3-(2-ethoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl}-4-hexylbenzamide

V003-2246 Screening compound: N-{3-[3-(2-ethoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl}-4-hexylbenzamide
V003-2246 Screening compound: N-{3-[3-(2-ethoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl}-4-hexylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-2246
N-{3-[3-(2-ethoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl}-4-hexylbenzamide

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

V003-2246

Molecular Formula

C30H34N2O3S (C30 H34 N2 O3 S)

Compound Name

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

IUPAC name

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

SMILES

CCCCCCc(cc1)ccc1C(Nc1cccc(C(N2c(cccc3)c3OCC)SCC2=O)c1)=O

InChI

InChI=1S/C30H34N2O3S/c1-3-5-6-7-11-22-16-18-23(19-17-22)29(34)31-25-13-10-12-24(20-25)30-32(28(33)21-36-30)26-14-8-9-15-27(26)35-4-2/h8-10,12-20,30H,3-7,11,21H2,1-2H3,(H,31,34)/t30-/m0/s1

InChI Key

XDTAEFBFRYCQKE-PMERELPUSA-N

MDL Number (MFCD)

MFCD19858406

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

502.68

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

7.568

Distribution Coefficient, logD

7.567

Water Solubility, LogSw

-5.55

Polar Surface Area

46.133

Acid Dissociation Constant (pKa)

10.76

Base Dissociation Constant (pKb)

-1.13

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

V003-2246 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
  • Cancer
Mechanism of action:
  • Epigenetic
  • PPI modulators

References: we are preparing a list of scientific research reports with V003-2246 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-2246?
Check Price and Availability of V003-2246, 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 V003-2246 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-2246
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-2246
  • 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 V003-2246 available by request