V016-4273 Screening compound: 2-(4-chlorophenyl)-4-({[2-(propan-2-yl)phenyl]sulfanyl}methyl)-1,3-thiazole

V016-4273 Screening compound: 2-(4-chlorophenyl)-4-({[2-(propan-2-yl)phenyl]sulfanyl}methyl)-1,3-thiazole
V016-4273 Screening compound: 2-(4-chlorophenyl)-4-({[2-(propan-2-yl)phenyl]sulfanyl}methyl)-1,3-thiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-4273
2-(4-chlorophenyl)-4-({[2-(propan-2-yl)phenyl]sulfanyl}methyl)-1,3-thiazole

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

V016-4273

Molecular Formula

C19H18ClNS2 (C19 H18 ClNS2)

Compound Name

2-(4-chlorophenyl)-4-({[2-(propan-2-yl)phenyl]sulfanyl}methyl)-1,3-thiazole

IUPAC name

2-(4-chlorophenyl)-4-({[2-(propan-2-yl)phenyl]sulfanyl}methyl)-13-thiazole

SMILES

CC(C)c(cccc1)c1SCc1csc(-c(cc2)ccc2Cl)n1

InChI

InChI=1S/C19H18ClNS2/c1-13(2)17-5-3-4-6-18(17)22-11-16-12-23-19(21-16)14-7-9-15(20)10-8-14/h3-10,12-13H,11H2,1-2H3

InChI Key

LSRMILBECUQYQU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19945022

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

359.94

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

1

Partition Coefficient, logP

6.762

Distribution Coefficient, logD

6.762

Water Solubility, LogSw

-6.74

Polar Surface Area

10.196

Acid Dissociation Constant (pKa)

24.08

Base Dissociation Constant (pKb)

-0.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

V016-4273 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 V016-4273 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-4273?
Check Price and Availability of V016-4273, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V016-4273 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-4273
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-4273
  • 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 V016-4273 available by request