0831-1267 Screening compound: 3,5-dichloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide

0831-1267 Screening compound: 3,5-dichloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide
0831-1267 Screening compound: 3,5-dichloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0831-1267
3,5-dichloro-N-(5-ethyl-1,3,4-thiadiazol-2-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

0831-1267

Molecular Formula

C11H9Cl2N3OS (C11 H9 Cl2 N3 OS)

Compound Name

3,5-dichloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide

IUPAC name

35-dichloro-N-(5-ethyl-134-thiadiazol-2-yl)benzamide

SMILES

CCc1nnc(NC(c2cc(Cl)cc(Cl)c2)=O)s1

InChI

InChI=1S/C11H9Cl2N3OS/c1-2-9-15-16-11(18-9)14-10(17)6-3-7(12)5-8(13)4-6/h3-5H,2H2,1H3,(H,14,16,17)

InChI Key

PXQHMYDYQSOIAM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01534008

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

302.18

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.196

Distribution Coefficient, logD

1.745

Water Solubility, LogSw

-4.48

Polar Surface Area

47.370

Acid Dissociation Constant (pKa)

4.95

Base Dissociation Constant (pKb)

-2.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

0831-1267 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Antiparasite Library (23996 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • Kinases
Agro:
  • Agro
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 0831-1267 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0831-1267?
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What is the minimum amount of 0831-1267 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0831-1267
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0831-1267
  • 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 0831-1267 available by request