0109-0187 Screening compound: 2-(4-chlorophenyl)-1H-1,3-benzodiazole

0109-0187 Screening compound: 2-(4-chlorophenyl)-1H-1,3-benzodiazole
0109-0187 Screening compound: 2-(4-chlorophenyl)-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 0109-0187
2-(4-chlorophenyl)-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

0109-0187

Molecular Formula

C13H9ClN2 (C13 H9 ClN2)

Compound Name

2-(4-chlorophenyl)-1H-1,3-benzodiazole

IUPAC name

2-(4-chlorophenyl)-1H-13-benzodiazole

SMILES

Clc(cc1)ccc1-c1nc(cccc2)c2[nH]1

InChI

InChI=1S/C13H9ClN2/c14-10-7-5-9(6-8-10)13-15-11-3-1-2-4-12(11)16-13/h1-8H,(H,15,16)

InChI Key

PTXUJRTVWRYYTE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00224359

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

228.68

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.115

Distribution Coefficient, logD

4.112

Water Solubility, LogSw

-4.70

Polar Surface Area

19.258

Acid Dissociation Constant (pKa)

11.59

Base Dissociation Constant (pKb)

5.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0109-0187 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Cardiovascular Library (22201 compounds)

GABA Library (7115 compounds)

Human Receptors Annotated Library (5376 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Ion Channels Focused Library (26372 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
  • Eye
  • Nervous system
  • Cardiovascular
Targets:
  • GPCR
  • Ion Channels
  • Ion Channels
Mechanism of action:
  • Receptor's ligands
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 0109-0187 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0109-0187?
Check Price and Availability of 0109-0187, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 0109-0187 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0109-0187
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0109-0187
  • 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 0109-0187 available by request