V004-2256 Screening compound: 2-{4-[(2,4-dichlorophenyl)methoxy]phenyl}-N-[2-(4-methoxyphenyl)ethyl]-1,3-thiazole-4-carboxamide

V004-2256 Screening compound: 2-{4-[(2,4-dichlorophenyl)methoxy]phenyl}-N-[2-(4-methoxyphenyl)ethyl]-1,3-thiazole-4-carboxamide
V004-2256 Screening compound: 2-{4-[(2,4-dichlorophenyl)methoxy]phenyl}-N-[2-(4-methoxyphenyl)ethyl]-1,3-thiazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-2256
2-{4-[(2,4-dichlorophenyl)methoxy]phenyl}-N-[2-(4-methoxyphenyl)ethyl]-1,3-thiazole-4-carboxamide

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

V004-2256

Molecular Formula

C26H22Cl2N2O3S (C26 H22 Cl2 N2 O3 S)

Compound Name

2-{4-[(2,4-dichlorophenyl)methoxy]phenyl}-N-[2-(4-methoxyphenyl)ethyl]-1,3-thiazole-4-carboxamide

IUPAC name

2-{4-[(24-dichlorophenyl)methoxy]phenyl}-N-[2-(4-methoxyphenyl)ethyl]-13-thiazole-4-carboxamide

SMILES

COc1ccc(CCNC(c2csc(-c(cc3)ccc3OCc(ccc(Cl)c3)c3Cl)n2)=O)cc1

InChI

InChI=1S/C26H22Cl2N2O3S/c1-32-21-8-2-17(3-9-21)12-13-29-25(31)24-16-34-26(30-24)18-5-10-22(11-6-18)33-15-19-4-7-20(27)14-23(19)28/h2-11,14,16H,12-13,15H2,1H3,(H,29,31)

InChI Key

PEKFWJMJWXDANZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19925532

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

513.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.605

Distribution Coefficient, logD

6.605

Water Solubility, LogSw

-6.30

Polar Surface Area

48.999

Acid Dissociation Constant (pKa)

14.40

Base Dissociation Constant (pKb)

-3.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

V004-2256 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V004-2256 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-2256?
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What is the minimum amount of V004-2256 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-2256
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-2256
  • 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 V004-2256 available by request