Y042-3024 Screening compound: methyl 2-amino-5-(4-chlorophenyl)-1,3-thiazole-4-carboxylate

Y042-3024 Screening compound: methyl 2-amino-5-(4-chlorophenyl)-1,3-thiazole-4-carboxylate
Y042-3024 Screening compound: methyl 2-amino-5-(4-chlorophenyl)-1,3-thiazole-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y042-3024
methyl 2-amino-5-(4-chlorophenyl)-1,3-thiazole-4-carboxylate

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

Y042-3024

Molecular Formula

C11H9ClN2O2S (C11 H9 ClN2 O2 S)

Compound Name

methyl 2-amino-5-(4-chlorophenyl)-1,3-thiazole-4-carboxylate

IUPAC name

methyl 2-amino-5-(4-chlorophenyl)-13-thiazole-4-carboxylate

SMILES

COC(c1c(-c(cc2)ccc2Cl)sc(N)n1)=O

InChI

InChI=1S/C11H9ClN2O2S/c1-16-10(15)8-9(17-11(13)14-8)6-2-4-7(12)5-3-6/h2-5H,1H3,(H2,13,14)

InChI Key

KMZCBFMFOJXUMA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06200914

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

268.72

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.118

Distribution Coefficient, logD

3.118

Water Solubility, LogSw

-3.57

Polar Surface Area

52.715

Acid Dissociation Constant (pKa)

20.58

Base Dissociation Constant (pKb)

0.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.09

Y042-3024 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Fragments Library (11262 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with Y042-3024 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y042-3024?
Check Price and Availability of Y042-3024, 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 Y042-3024 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y042-3024
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y042-3024
  • 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 Y042-3024 available by request