V022-6827 Screening compound: N-benzyl-2-{4-[(2-chloro-6-fluorophenyl)methoxy]phenyl}-N-methyl-1,3-thiazole-4-carboxamide

V022-6827 Screening compound: N-benzyl-2-{4-[(2-chloro-6-fluorophenyl)methoxy]phenyl}-N-methyl-1,3-thiazole-4-carboxamide
V022-6827 Screening compound: N-benzyl-2-{4-[(2-chloro-6-fluorophenyl)methoxy]phenyl}-N-methyl-1,3-thiazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-6827
N-benzyl-2-{4-[(2-chloro-6-fluorophenyl)methoxy]phenyl}-N-methyl-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

V022-6827

Molecular Formula

C25H20ClFN2O2S (C25 H20 ClFN2 O2 S)

Compound Name

N-benzyl-2-{4-[(2-chloro-6-fluorophenyl)methoxy]phenyl}-N-methyl-1,3-thiazole-4-carboxamide

IUPAC name

N-benzyl-2-{4-[(2-chloro-6-fluorophenyl)methoxy]phenyl}-N-methyl-13-thiazole-4-carboxamide

SMILES

CN(Cc1ccccc1)C(c1csc(-c(cc2)ccc2OCc(c(F)ccc2)c2Cl)n1)=O

InChI

InChI=1S/C25H20ClFN2O2S/c1-29(14-17-6-3-2-4-7-17)25(30)23-16-32-24(28-23)18-10-12-19(13-11-18)31-15-20-21(26)8-5-9-22(20)27/h2-13,16H,14-15H2,1H3

InChI Key

XDOITRNEHCCTMF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19925509

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.96

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.296

Distribution Coefficient, logD

6.296

Water Solubility, LogSw

-6.08

Polar Surface Area

33.350

Acid Dissociation Constant (pKa)

27.89

Base Dissociation Constant (pKb)

-5.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.00

V022-6827 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with V022-6827 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-6827?
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What is the minimum amount of V022-6827 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-6827
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-6827
  • 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 V022-6827 available by request