C200-9133 Screening compound: 5-methyl-4-[({1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}sulfanyl)methyl]-2-(3-methylphenyl)-1,3-oxazole

C200-9133 Screening compound: 5-methyl-4-[({1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}sulfanyl)methyl]-2-(3-methylphenyl)-1,3-oxazole
C200-9133 Screening compound: 5-methyl-4-[({1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}sulfanyl)methyl]-2-(3-methylphenyl)-1,3-oxazole alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-9133
5-methyl-4-[({1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}sulfanyl)methyl]-2-(3-methylphenyl)-1,3-oxazole

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

C200-9133

Molecular Formula

C22H19N5OS (C22 H19 N5 OS)

Compound Name

5-methyl-4-[({1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}sulfanyl)methyl]-2-(3-methylphenyl)-1,3-oxazole

IUPAC name

5-methyl-4-[({1-methyl-[124]triazolo[43-a]quinoxalin-4-yl}sulfanyl)methyl]-2-(3-methylphenyl)-13-oxazole

SMILES

Cc1c(CSc2nc(cccc3)c3n3c2nnc3C)nc(-c2cc(C)ccc2)o1

InChI

InChI=1S/C22H19N5OS/c1-13-7-6-8-16(11-13)21-23-18(14(2)28-21)12-29-22-20-26-25-15(3)27(20)19-10-5-4-9-17(19)24-22/h4-11H,12H2,1-3H3

InChI Key

SADJXFLWRGRSTF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD16639598

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.350

Distribution Coefficient, logD

4.349

Water Solubility, LogSw

-4.43

Polar Surface Area

48.679

Acid Dissociation Constant (pKa)

27.87

Base Dissociation Constant (pKb)

3.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

C200-9133 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • 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 C200-9133 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-9133?
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What is the minimum amount of C200-9133 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-9133
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-9133
  • 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 C200-9133 available by request