V016-4384 Screening compound: N-(cyclopropylmethyl)-2-{2-[(2,4-dichlorophenyl)methoxy]phenyl}-1,3-thiazole-4-carboxamide

V016-4384 Screening compound: N-(cyclopropylmethyl)-2-{2-[(2,4-dichlorophenyl)methoxy]phenyl}-1,3-thiazole-4-carboxamide
V016-4384 Screening compound: N-(cyclopropylmethyl)-2-{2-[(2,4-dichlorophenyl)methoxy]phenyl}-1,3-thiazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-4384
N-(cyclopropylmethyl)-2-{2-[(2,4-dichlorophenyl)methoxy]phenyl}-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

V016-4384

Molecular Formula

C21H18Cl2N2O2S (C21 H18 Cl2 N2 O2 S)

Compound Name

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

IUPAC name

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

SMILES

O=C(c1csc(-c(cccc2)c2OCc(ccc(Cl)c2)c2Cl)n1)NCC1CC1

InChI

InChI=1S/C21H18Cl2N2O2S/c22-15-8-7-14(17(23)9-15)11-27-19-4-2-1-3-16(19)21-25-18(12-28-21)20(26)24-10-13-5-6-13/h1-4,7-9,12-13H,5-6,10-11H2,(H,24,26)

InChI Key

NTHHNMXZAUCCEL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19928007

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

433.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.043

Distribution Coefficient, logD

6.043

Water Solubility, LogSw

-6.08

Polar Surface Area

42.223

Acid Dissociation Constant (pKa)

15.94

Base Dissociation Constant (pKb)

-2.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

V016-4384 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 V016-4384 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-4384?
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What is the minimum amount of V016-4384 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-4384
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-4384
  • 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 V016-4384 available by request