D670-0254 Screening compound: 5-chloro-2-[1-(2-chlorophenoxy)ethyl]-1H-1,3-benzodiazole

D670-0254 Screening compound: 5-chloro-2-[1-(2-chlorophenoxy)ethyl]-1H-1,3-benzodiazole
D670-0254 Screening compound: 5-chloro-2-[1-(2-chlorophenoxy)ethyl]-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound D670-0254
5-chloro-2-[1-(2-chlorophenoxy)ethyl]-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

D670-0254

Molecular Formula

C15H12Cl2N2O (C15 H12 Cl2 N2 O)

Compound Name

5-chloro-2-[1-(2-chlorophenoxy)ethyl]-1H-1,3-benzodiazole

IUPAC name

5-chloro-2-[1-(2-chlorophenoxy)ethyl]-1H-13-benzodiazole

SMILES

CC(c1nc(cc(cc2)Cl)c2[nH]1)Oc(cccc1)c1Cl

InChI

InChI=1S/C15H12Cl2N2O/c1-9(20-14-5-3-2-4-11(14)17)15-18-12-7-6-10(16)8-13(12)19-15/h2-9H,1H3,(H,18,19)/t9-/m0/s1

InChI Key

DJLWLWQNDXANOI-VIFPVBQESA-N

MDL Number (MFCD)

MFCD27595527

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

307.18

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.948

Distribution Coefficient, logD

4.948

Water Solubility, LogSw

-5.11

Polar Surface Area

26.134

Acid Dissociation Constant (pKa)

10.69

Base Dissociation Constant (pKb)

3.66

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.30

D670-0254 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS Targets (44014 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels
  • Ion Channels

References: we are preparing a list of scientific research reports with D670-0254 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D670-0254?
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What is the minimum amount of D670-0254 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D670-0254
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D670-0254
  • 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 D670-0254 available by request