1988-1436 Screening compound: 4-bromophenyl 1-benzofuran-2-carboxylate

1988-1436 Screening compound: 4-bromophenyl 1-benzofuran-2-carboxylate
1988-1436 Screening compound: 4-bromophenyl 1-benzofuran-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1988-1436
4-bromophenyl 1-benzofuran-2-carboxylate

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

1988-1436

Molecular Formula

C15H9BrO3 (C15 H9 BrO3)

Compound Name

4-bromophenyl 1-benzofuran-2-carboxylate

IUPAC name

4-bromophenyl 1-benzofuran-2-carboxylate

SMILES

O=C(c1cc(cccc2)c2o1)Oc(cc1)ccc1Br

InChI

InChI=1S/C15H9BrO3/c16-11-5-7-12(8-6-11)18-15(17)14-9-10-3-1-2-4-13(10)19-14/h1-9H

InChI Key

DZEXKULRXYBNMG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01181769

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

317.14

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.958

Distribution Coefficient, logD

4.958

Water Solubility, LogSw

-5.67

Polar Surface Area

28.909

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

1988-1436 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 1988-1436 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1988-1436?
Check Price and Availability of 1988-1436, 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 1988-1436 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1988-1436
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1988-1436
  • 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 1988-1436 available by request