3260-0478 Screening compound: 1-[2-(4-chlorophenoxy)ethyl]-2-methyl-1H-1,3-benzodiazole

3260-0478 Screening compound: 1-[2-(4-chlorophenoxy)ethyl]-2-methyl-1H-1,3-benzodiazole
3260-0478 Screening compound: 1-[2-(4-chlorophenoxy)ethyl]-2-methyl-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 3260-0478
1-[2-(4-chlorophenoxy)ethyl]-2-methyl-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

3260-0478

Molecular Formula

C16H15ClN2O (C16 H15 ClN2 O)

Compound Name

1-[2-(4-chlorophenoxy)ethyl]-2-methyl-1H-1,3-benzodiazole

IUPAC name

1-[2-(4-chlorophenoxy)ethyl]-2-methyl-1H-13-benzodiazole

SMILES

Cc1nc(cccc2)c2n1CCOc(cc1)ccc1Cl

InChI

InChI=1S/C16H15ClN2O/c1-12-18-15-4-2-3-5-16(15)19(12)10-11-20-14-8-6-13(17)7-9-14/h2-9H,10-11H2,1H3

InChI Key

MLKXHRPFRHZMHU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01056121

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

286.76

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.345

Distribution Coefficient, logD

4.344

Water Solubility, LogSw

-4.46

Polar Surface Area

18.340

Acid Dissociation Constant (pKa)

23.66

Base Dissociation Constant (pKb)

4.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

3260-0478 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

CNS BBB Library (22607 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 3260-0478 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3260-0478?
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What is the minimum amount of 3260-0478 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3260-0478
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3260-0478
  • 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 3260-0478 available by request