M213-0036 Screening compound: 3-[1-(3-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-N-phenyl-1,2,4-thiadiazol-5-amine

M213-0036 Screening compound: 3-[1-(3-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-N-phenyl-1,2,4-thiadiazol-5-amine
M213-0036 Screening compound: 3-[1-(3-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-N-phenyl-1,2,4-thiadiazol-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound M213-0036
3-[1-(3-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-N-phenyl-1,2,4-thiadiazol-5-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

M213-0036

Molecular Formula

C17H13ClN6S (C17 H13 ClN6 S)

Compound Name

3-[1-(3-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-N-phenyl-1,2,4-thiadiazol-5-amine

IUPAC name

3-[1-(3-chlorophenyl)-5-methyl-1H-123-triazol-4-yl]-N-phenyl-124-thiadiazol-5-amine

SMILES

Cc1c(-c2nsc(Nc3ccccc3)n2)nnn1-c1cccc(Cl)c1

InChI

InChI=1S/C17H13ClN6S/c1-11-15(21-23-24(11)14-9-5-6-12(18)10-14)16-20-17(25-22-16)19-13-7-3-2-4-8-13/h2-10H,1H3,(H,19,20,22)

InChI Key

SYGSPZIRZYQIIU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27534220

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.85

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.622

Distribution Coefficient, logD

4.622

Water Solubility, LogSw

-4.63

Polar Surface Area

56.582

Acid Dissociation Constant (pKa)

19.84

Base Dissociation Constant (pKb)

2.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

M213-0036 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Infections
  • Immune system
  • animal
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with M213-0036 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M213-0036?
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What is the minimum amount of M213-0036 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M213-0036
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M213-0036
  • 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 M213-0036 available by request