6481-7363 Screening compound: 1-(1,3-benzodioxol-5-yl)-2-{[5-(4-chlorophenyl)[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl]sulfanyl}-1-ethanone

6481-7363 Screening compound: 1-(1,3-benzodioxol-5-yl)-2-{[5-(4-chlorophenyl)[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl]sulfanyl}-1-ethanone
6481-7363 Screening compound: 1-(1,3-benzodioxol-5-yl)-2-{[5-(4-chlorophenyl)[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl]sulfanyl}-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound 6481-7363
1-(1,3-benzodioxol-5-yl)-2-{[5-(4-chlorophenyl)[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl]sulfanyl}-1-ethanone

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

6481-7363

Molecular Formula

C19H12ClN3O3S2 (C19 H12 ClN3 O3 S2)

Compound Name

1-(1,3-benzodioxol-5-yl)-2-{[5-(4-chlorophenyl)[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl]sulfanyl}-1-ethanone

IUPAC name

n/a

SMILES

O=C(CSc1nnc2scc(-c(cc3)ccc3Cl)n12)c(cc1)cc2c1OCO2

InChI

InChI=1S/C19H12ClN3O3S2/c20-13-4-1-11(2-5-13)14-8-27-18-21-22-19(23(14)18)28-9-15(24)12-3-6-16-17(7-12)26-10-25-16/h1-8H,9-10H2

InChI Key

VHMOCXMETUYJEX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05866329

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.91

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.997

Distribution Coefficient, logD

4.997

Water Solubility, LogSw

-5.31

Polar Surface Area

52.148

Acid Dissociation Constant (pKa)

16.52

Base Dissociation Constant (pKb)

-0.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

6481-7363 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Antiparasite Library (23996 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Agro:
  • Agro
  • Agro
Targets:
  • Others

References: we are preparing a list of scientific research reports with 6481-7363 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6481-7363?
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What is the minimum amount of 6481-7363 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6481-7363
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6481-7363
  • 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 6481-7363 available by request