D078-0127 Screening compound: 1-(2-chlorobenzoyl)-1H-1,3-benzodiazole

D078-0127 Screening compound: 1-(2-chlorobenzoyl)-1H-1,3-benzodiazole
D078-0127 Screening compound: 1-(2-chlorobenzoyl)-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound D078-0127
1-(2-chlorobenzoyl)-1H-1,3-benzodiazole

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

D078-0127

Molecular Formula

C14H9ClN2O (C14 H9 ClN2 O)

Compound Name

1-(2-chlorobenzoyl)-1H-1,3-benzodiazole

IUPAC name

1-(2-chlorobenzoyl)-1H-13-benzodiazole

SMILES

O=C(c(cccc1)c1Cl)n1c(cccc2)c2nc1

InChI

InChI=1S/C14H9ClN2O/c15-11-6-2-1-5-10(11)14(18)17-9-16-12-7-3-4-8-13(12)17/h1-9H

InChI Key

DQQBUHMCOHIYNE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00590060

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

256.69

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.705

Distribution Coefficient, logD

2.705

Water Solubility, LogSw

-3.65

Polar Surface Area

24.078

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

2.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

D078-0127 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D078-0127 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D078-0127?
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What is the minimum amount of D078-0127 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D078-0127
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D078-0127
  • 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 D078-0127 available by request