0095-0332 Screening compound: 2-[(1,3-dioxo-2,3-dihydro-1H-inden-2-yl)(phenyl)methyl]-2,3-dihydro-1H-indene-1,3-dione

0095-0332 Screening compound: 2-[(1,3-dioxo-2,3-dihydro-1H-inden-2-yl)(phenyl)methyl]-2,3-dihydro-1H-indene-1,3-dione
0095-0332 Screening compound: 2-[(1,3-dioxo-2,3-dihydro-1H-inden-2-yl)(phenyl)methyl]-2,3-dihydro-1H-indene-1,3-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 0095-0332
2-[(1,3-dioxo-2,3-dihydro-1H-inden-2-yl)(phenyl)methyl]-2,3-dihydro-1H-indene-1,3-dione

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

0095-0332

Molecular Formula

C25H16O4 (C25 H16 O4)

Compound Name

2-[(1,3-dioxo-2,3-dihydro-1H-inden-2-yl)(phenyl)methyl]-2,3-dihydro-1H-indene-1,3-dione

IUPAC name

2-[(13-dioxo-23-dihydro-1H-inden-2-yl)(phenyl)methyl]-23-dihydro-1H-indene-13-dione

SMILES

O=C(C1C(C(C(c2c3cccc2)=O)C3=O)c2ccccc2)c(cccc2)c2C1=O

InChI

InChI=1S/C25H16O4/c26-22-15-10-4-5-11-16(15)23(27)20(22)19(14-8-2-1-3-9-14)21-24(28)17-12-6-7-13-18(17)25(21)29/h1-13,19-21H

InChI Key

AEKFPJQSPBTNGY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00183003

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.4

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.997

Distribution Coefficient, logD

-2.418

Water Solubility, LogSw

-4.49

Polar Surface Area

52.854

Acid Dissociation Constant (pKa)

0.98

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.00

0095-0332 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 0095-0332 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0095-0332?
Check Price and Availability of 0095-0332, 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 0095-0332 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0095-0332
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0095-0332
  • 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 0095-0332 available by request