V027-4522 Screening compound: N-{2-[2-(4-tert-butylphenyl)-5-methyl-4-oxo-1,3-thiazolidin-3-yl]ethyl}-2-chloro-N-ethylbenzamide

V027-4522 Screening compound: N-{2-[2-(4-tert-butylphenyl)-5-methyl-4-oxo-1,3-thiazolidin-3-yl]ethyl}-2-chloro-N-ethylbenzamide
V027-4522 Screening compound: N-{2-[2-(4-tert-butylphenyl)-5-methyl-4-oxo-1,3-thiazolidin-3-yl]ethyl}-2-chloro-N-ethylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-4522
N-{2-[2-(4-tert-butylphenyl)-5-methyl-4-oxo-1,3-thiazolidin-3-yl]ethyl}-2-chloro-N-ethylbenzamide

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

V027-4522

Molecular Formula

C25H31ClN2O2S (C25 H31 ClN2 O2 S)

Compound Name

N-{2-[2-(4-tert-butylphenyl)-5-methyl-4-oxo-1,3-thiazolidin-3-yl]ethyl}-2-chloro-N-ethylbenzamide

IUPAC name

N-{2-[2-(4-tert-butylphenyl)-5-methyl-4-oxo-13-thiazolidin-3-yl]ethyl}-2-chloro-N-ethylbenzamide

SMILES

CCN(CCN(C(c1ccc(C(C)(C)C)cc1)SC1C)C1=O)C(c(cccc1)c1Cl)=O

InChI

InChI=1S/C25H31ClN2O2S/c1-6-27(23(30)20-9-7-8-10-21(20)26)15-16-28-22(29)17(2)31-24(28)18-11-13-19(14-12-18)25(3,4)5/h7-14,17,24H,6,15-16H2,1-5H3

InChI Key

IYAGNHNLGHEWKN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19797353

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.05

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.901

Distribution Coefficient, logD

5.901

Water Solubility, LogSw

-5.85

Polar Surface Area

32.631

Acid Dissociation Constant (pKa)

14.80

Base Dissociation Constant (pKb)

-2.91

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

44.00

References: we are preparing a list of scientific research reports with V027-4522 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-4522?
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What is the minimum amount of V027-4522 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-4522
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-4522
  • 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 V027-4522 available by request