0659-0002 Screening compound: (2E,5E)-2,5-bis(phenylmethylidene)cyclopentan-1-one

0659-0002 Screening compound: (2E,5E)-2,5-bis(phenylmethylidene)cyclopentan-1-one
0659-0002 Screening compound: (2E,5E)-2,5-bis(phenylmethylidene)cyclopentan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 0659-0002
(2E,5E)-2,5-bis(phenylmethylidene)cyclopentan-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

0659-0002

Molecular Formula

C19H16O (C19 H16 O)

Compound Name

(2E,5E)-2,5-bis(phenylmethylidene)cyclopentan-1-one

IUPAC name

(2E5E)-25-bis(phenylmethylidene)cyclopentan-1-one

SMILES

O=C(/C(/CC1)=C/c2ccccc2)/C1=C/c1ccccc1

InChI

InChI=1S/C19H16O/c20-19-17(13-15-7-3-1-4-8-15)11-12-18(19)14-16-9-5-2-6-10-16/h1-10,13-14H,11-12H2

InChI Key

CVTOCKKPVXJIJK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00019321

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

260.34

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

1

Partition Coefficient, logP

4.669

Distribution Coefficient, logD

4.669

Water Solubility, LogSw

-4.75

Polar Surface Area

13.400

Acid Dissociation Constant (pKa)

29.57

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

0659-0002 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Frequent Hitters Library (7624 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 0659-0002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0659-0002?
Check Price and Availability of 0659-0002, 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 0659-0002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0659-0002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0659-0002
  • 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 0659-0002 available by request