8011-6979 Screening compound: 2-chloro-N-[4-(1-methyl-1H-1,3-benzodiazol-2-yl)-1,2,5-oxadiazol-3-yl]benzamide

8011-6979 Screening compound: 2-chloro-N-[4-(1-methyl-1H-1,3-benzodiazol-2-yl)-1,2,5-oxadiazol-3-yl]benzamide
8011-6979 Screening compound: 2-chloro-N-[4-(1-methyl-1H-1,3-benzodiazol-2-yl)-1,2,5-oxadiazol-3-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8011-6979
2-chloro-N-[4-(1-methyl-1H-1,3-benzodiazol-2-yl)-1,2,5-oxadiazol-3-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

8011-6979

Molecular Formula

C17H12ClN5O2 (C17 H12 ClN5 O2)

Compound Name

2-chloro-N-[4-(1-methyl-1H-1,3-benzodiazol-2-yl)-1,2,5-oxadiazol-3-yl]benzamide

IUPAC name

2-chloro-N-[4-(1-methyl-1H-13-benzodiazol-2-yl)-125-oxadiazol-3-yl]benzamide

SMILES

Cn1c(-c2nonc2NC(c(cccc2)c2Cl)=O)nc2c1cccc2

InChI

InChI=1S/C17H12ClN5O2/c1-23-13-9-5-4-8-12(13)19-16(23)14-15(22-25-21-14)20-17(24)10-6-2-3-7-11(10)18/h2-9H,1H3,(H,20,22,24)

InChI Key

DGKDWSQAHADIBC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02921455

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

353.77

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.939

Distribution Coefficient, logD

2.739

Water Solubility, LogSw

-4.30

Polar Surface Area

71.096

Acid Dissociation Constant (pKa)

6.23

Base Dissociation Constant (pKb)

3.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

8011-6979 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Kinases
  • Kinases

References: we are preparing a list of scientific research reports with 8011-6979 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8011-6979?
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What is the minimum amount of 8011-6979 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8011-6979
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8011-6979
  • 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 8011-6979 available by request