G193-0312 Screening compound: N-{3-[1-(2,5-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-3,5-dimethoxybenzamide

G193-0312 Screening compound: N-{3-[1-(2,5-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-3,5-dimethoxybenzamide
G193-0312 Screening compound: N-{3-[1-(2,5-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-3,5-dimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G193-0312
N-{3-[1-(2,5-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-3,5-dimethoxybenzamide

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

G193-0312

Molecular Formula

C22H22N6O3S (C22 H22 N6 O3 S)

Compound Name

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

IUPAC name

N-{3-[1-(25-dimethylphenyl)-5-methyl-1H-123-triazol-4-yl]-124-thiadiazol-5-yl}-35-dimethoxybenzamide

SMILES

Cc1c(-c2nsc(NC(c3cc(OC)cc(OC)c3)=O)n2)nnn1-c1c(C)ccc(C)c1

InChI

InChI=1S/C22H22N6O3S/c1-12-6-7-13(2)18(8-12)28-14(3)19(25-27-28)20-23-22(32-26-20)24-21(29)15-9-16(30-4)11-17(10-15)31-5/h6-11H,1-5H3,(H,23,24,26,29)

InChI Key

PDNODGJGFOERCD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14983216

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.755

Distribution Coefficient, logD

4.755

Water Solubility, LogSw

-4.55

Polar Surface Area

85.547

Acid Dissociation Constant (pKa)

10.63

Base Dissociation Constant (pKb)

2.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

G193-0312 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G193-0312 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G193-0312?
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What is the minimum amount of G193-0312 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G193-0312
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G193-0312
  • 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 G193-0312 available by request