M213-0429 Screening compound: N-(4-ethoxyphenyl)-3-[1-(4-methoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-amine

M213-0429 Screening compound: N-(4-ethoxyphenyl)-3-[1-(4-methoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-amine
M213-0429 Screening compound: N-(4-ethoxyphenyl)-3-[1-(4-methoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound M213-0429
N-(4-ethoxyphenyl)-3-[1-(4-methoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-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

M213-0429

Molecular Formula

C20H20N6O2S (C20 H20 N6 O2 S)

Compound Name

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

IUPAC name

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

SMILES

CCOc(cc1)ccc1Nc1nc(-c2c(C)n(-c(cc3)ccc3OC)nn2)ns1

InChI

InChI=1S/C20H20N6O2S/c1-4-28-17-9-5-14(6-10-17)21-20-22-19(24-29-20)18-13(2)26(25-23-18)15-7-11-16(27-3)12-8-15/h5-12H,4H2,1-3H3,(H,21,22,24)

InChI Key

PYIIKXJBJBOMHS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27534238

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.530

Distribution Coefficient, logD

4.530

Water Solubility, LogSw

-4.20

Polar Surface Area

71.249

Acid Dissociation Constant (pKa)

19.52

Base Dissociation Constant (pKb)

2.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

M213-0429 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with M213-0429 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M213-0429?
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What is the minimum amount of M213-0429 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M213-0429
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M213-0429
  • 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 M213-0429 available by request