G193-0544 Screening compound: 2-methyl-N-(3-{5-methyl-1-[2-(trifluoromethyl)phenyl]-1H-1,2,3-triazol-4-yl}-1,2,4-thiadiazol-5-yl)benzamide

G193-0544 Screening compound: 2-methyl-N-(3-{5-methyl-1-[2-(trifluoromethyl)phenyl]-1H-1,2,3-triazol-4-yl}-1,2,4-thiadiazol-5-yl)benzamide
G193-0544 Screening compound: 2-methyl-N-(3-{5-methyl-1-[2-(trifluoromethyl)phenyl]-1H-1,2,3-triazol-4-yl}-1,2,4-thiadiazol-5-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G193-0544
2-methyl-N-(3-{5-methyl-1-[2-(trifluoromethyl)phenyl]-1H-1,2,3-triazol-4-yl}-1,2,4-thiadiazol-5-yl)benzamide

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

G193-0544

Molecular Formula

C20H15F3N6OS (C20 H15 F3 N6 OS)

Compound Name

2-methyl-N-(3-{5-methyl-1-[2-(trifluoromethyl)phenyl]-1H-1,2,3-triazol-4-yl}-1,2,4-thiadiazol-5-yl)benzamide

IUPAC name

2-methyl-N-(3-{5-methyl-1-[2-(trifluoromethyl)phenyl]-1H-123-triazol-4-yl}-124-thiadiazol-5-yl)benzamide

SMILES

Cc1c(-c2nsc(NC(c3c(C)cccc3)=O)n2)nnn1-c1c(C(F)(F)F)cccc1

InChI

InChI=1S/C20H15F3N6OS/c1-11-7-3-4-8-13(11)18(30)25-19-24-17(27-31-19)16-12(2)29(28-26-16)15-10-6-5-9-14(15)20(21,22)23/h3-10H,1-2H3,(H,24,25,27,30)

InChI Key

HXRSBPHRAYTUKV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14983368

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.44

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

4.470

Distribution Coefficient, logD

4.456

Water Solubility, LogSw

-4.43

Polar Surface Area

70.459

Acid Dissociation Constant (pKa)

8.88

Base Dissociation Constant (pKb)

-0.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

G193-0544 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with G193-0544 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G193-0544?
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What is the minimum amount of G193-0544 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G193-0544
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G193-0544
  • 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 G193-0544 available by request