1774-0140 Screening compound: 1-[2-(4-bromophenoxy)ethyl]-2-methyl-1H-1,3-benzodiazole

1774-0140 Screening compound: 1-[2-(4-bromophenoxy)ethyl]-2-methyl-1H-1,3-benzodiazole
1774-0140 Screening compound: 1-[2-(4-bromophenoxy)ethyl]-2-methyl-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 1774-0140
1-[2-(4-bromophenoxy)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

1774-0140

Molecular Formula

C16H15BrN2O (C16 H15 BrN2 O)

Compound Name

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

IUPAC name

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

SMILES

Cc1nc(cccc2)c2n1CCOc(cc1)ccc1Br

InChI

InChI=1S/C16H15BrN2O/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

KTPHHVPYEAEAIG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00840878

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

331.21

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

4.584

Distribution Coefficient, logD

4.583

Water Solubility, LogSw

-4.35

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

1774-0140 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 1774-0140 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1774-0140?
Check Price and Availability of 1774-0140, 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 1774-0140 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1774-0140
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1774-0140
  • 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 1774-0140 available by request