V015-5988 Screening compound: 2-{2-[(2,4-dichlorophenyl)methoxy]phenyl}-N-[2-(pyridin-2-yl)ethyl]-1,3-thiazole-4-carboxamide

V015-5988 Screening compound: 2-{2-[(2,4-dichlorophenyl)methoxy]phenyl}-N-[2-(pyridin-2-yl)ethyl]-1,3-thiazole-4-carboxamide
V015-5988 Screening compound: 2-{2-[(2,4-dichlorophenyl)methoxy]phenyl}-N-[2-(pyridin-2-yl)ethyl]-1,3-thiazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V015-5988
2-{2-[(2,4-dichlorophenyl)methoxy]phenyl}-N-[2-(pyridin-2-yl)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

V015-5988

Molecular Formula

C24H19Cl2N3O2S (C24 H19 Cl2 N3 O2 S)

Compound Name

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

IUPAC name

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

SMILES

O=C(c1csc(-c(cccc2)c2OCc(ccc(Cl)c2)c2Cl)n1)NCCc1ncccc1

InChI

InChI=1S/C24H19Cl2N3O2S/c25-17-9-8-16(20(26)13-17)14-31-22-7-2-1-6-19(22)24-29-21(15-32-24)23(30)28-12-10-18-5-3-4-11-27-18/h1-9,11,13,15H,10,12,14H2,(H,28,30)

InChI Key

LHTJJJUJZULGCV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19927044

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

484.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.738

Distribution Coefficient, logD

5.738

Water Solubility, LogSw

-5.90

Polar Surface Area

51.084

Acid Dissociation Constant (pKa)

14.54

Base Dissociation Constant (pKb)

4.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

V015-5988 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 V015-5988 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V015-5988?
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What is the minimum amount of V015-5988 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V015-5988
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V015-5988
  • 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 V015-5988 available by request