3586-0183 Screening compound: 3-(4-chlorophenyl)-1,3-dihydro-2-benzofuran-1-one

3586-0183 Screening compound: 3-(4-chlorophenyl)-1,3-dihydro-2-benzofuran-1-one
3586-0183 Screening compound: 3-(4-chlorophenyl)-1,3-dihydro-2-benzofuran-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3586-0183
3-(4-chlorophenyl)-1,3-dihydro-2-benzofuran-1-one

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

3586-0183

Molecular Formula

C14H9ClO2 (C14 H9 ClO2)

Compound Name

3-(4-chlorophenyl)-1,3-dihydro-2-benzofuran-1-one

IUPAC name

3-(4-chlorophenyl)-13-dihydro-2-benzofuran-1-one

SMILES

O=C(c1c2cccc1)OC2c(cc1)ccc1Cl

InChI

InChI=1S/C14H9ClO2/c15-10-7-5-9(6-8-10)13-11-3-1-2-4-12(11)14(16)17-13/h1-8,13H/t13-/m1/s1

InChI Key

SUSCNWIPCFTMMQ-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD02030481

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

244.68

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

3.379

Distribution Coefficient, logD

3.379

Water Solubility, LogSw

-4.04

Polar Surface Area

21.773

Acid Dissociation Constant (pKa)

21.42

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

7.10

3586-0183 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with 3586-0183 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3586-0183?
Check Price and Availability of 3586-0183, 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 3586-0183 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3586-0183
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3586-0183
  • 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 3586-0183 available by request