G193-0182 Screening compound: N-{3-[1-(3-ethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-4-methylbenzamide

G193-0182 Screening compound: N-{3-[1-(3-ethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-4-methylbenzamide
G193-0182 Screening compound: N-{3-[1-(3-ethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-4-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G193-0182
N-{3-[1-(3-ethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-4-methylbenzamide

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

G193-0182

Molecular Formula

C21H20N6OS (C21 H20 N6 OS)

Compound Name

N-{3-[1-(3-ethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-4-methylbenzamide

IUPAC name

N-{3-[1-(3-ethylphenyl)-5-methyl-1H-123-triazol-4-yl]-124-thiadiazol-5-yl}-4-methylbenzamide

SMILES

CCc1cccc(-n2nnc(-c3nsc(NC(c4ccc(C)cc4)=O)n3)c2C)c1

InChI

InChI=1S/C21H20N6OS/c1-4-15-6-5-7-17(12-15)27-14(3)18(24-26-27)19-22-21(29-25-19)23-20(28)16-10-8-13(2)9-11-16/h5-12H,4H2,1-3H3,(H,22,23,25,28)

InChI Key

DBMBCYXAYGUCDP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14983158

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.839

Distribution Coefficient, logD

4.833

Water Solubility, LogSw

-4.61

Polar Surface Area

70.760

Acid Dissociation Constant (pKa)

9.32

Base Dissociation Constant (pKb)

1.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

G193-0182 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G193-0182 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G193-0182?
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What is the minimum amount of G193-0182 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G193-0182
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G193-0182
  • 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 G193-0182 available by request