4469-0741 Screening compound: 5-{2-[(3-chloro-2-methylphenyl)amino]-1,3-thiazol-4-yl}-4-methyl-1,3-thiazol-2-amine

4469-0741 Screening compound: 5-{2-[(3-chloro-2-methylphenyl)amino]-1,3-thiazol-4-yl}-4-methyl-1,3-thiazol-2-amine
4469-0741 Screening compound: 5-{2-[(3-chloro-2-methylphenyl)amino]-1,3-thiazol-4-yl}-4-methyl-1,3-thiazol-2-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4469-0741
5-{2-[(3-chloro-2-methylphenyl)amino]-1,3-thiazol-4-yl}-4-methyl-1,3-thiazol-2-amine

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

4469-0741

Molecular Formula

C14H13ClN4S2 (C14 H13 ClN4 S2)

Compound Name

5-{2-[(3-chloro-2-methylphenyl)amino]-1,3-thiazol-4-yl}-4-methyl-1,3-thiazol-2-amine

IUPAC name

5-{2-[(3-chloro-2-methylphenyl)amino]-13-thiazol-4-yl}-4-methyl-13-thiazol-2-amine

SMILES

Cc1c(-c2csc(Nc3cccc(Cl)c3C)n2)sc(N)n1

InChI

InChI=1S/C14H13ClN4S2/c1-7-9(15)4-3-5-10(7)18-14-19-11(6-20-14)12-8(2)17-13(16)21-12/h3-6H,1-2H3,(H2,16,17)(H,18,19)

InChI Key

VTTGHLPWXTVZGV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02578594

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.87

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.266

Distribution Coefficient, logD

5.171

Water Solubility, LogSw

-5.92

Polar Surface Area

49.608

Acid Dissociation Constant (pKa)

18.98

Base Dissociation Constant (pKb)

6.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

4469-0741 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 4469-0741 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4469-0741?
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What is the minimum amount of 4469-0741 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4469-0741
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4469-0741
  • 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 4469-0741 available by request