0133-0065 Screening compound: 4,5-diphenyl-2,3-dihydro-1H-imidazol-2-one

0133-0065 Screening compound: 4,5-diphenyl-2,3-dihydro-1H-imidazol-2-one
0133-0065 Screening compound: 4,5-diphenyl-2,3-dihydro-1H-imidazol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 0133-0065
4,5-diphenyl-2,3-dihydro-1H-imidazol-2-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

0133-0065

Molecular Formula

C15H12N2O (C15 H12 N2 O)

Compound Name

4,5-diphenyl-2,3-dihydro-1H-imidazol-2-one

IUPAC name

45-diphenyl-23-dihydro-1H-imidazol-2-one

SMILES

O=C1NC(c2ccccc2)=C(c2ccccc2)N1

InChI

InChI=1S/C15H12N2O/c18-15-16-13(11-7-3-1-4-8-11)14(17-15)12-9-5-2-6-10-12/h1-10H,(H2,16,17,18)

InChI Key

JAWYWGRTWUVTEN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00022393

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

236.27

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.850

Distribution Coefficient, logD

2.106

Water Solubility, LogSw

-3.25

Polar Surface Area

35.456

Acid Dissociation Constant (pKa)

6.74

Base Dissociation Constant (pKb)

0.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0133-0065 in Drug Discovery

Included in Screening Libraries

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

Cardiovascular Library (22201 compounds)

Fragments Library (11262 compounds)

Frequent Hitters Library (7624 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
Structure:
  • Fragments
  • Pool
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 0133-0065 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0133-0065?
Check Price and Availability of 0133-0065, 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 0133-0065 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0133-0065
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0133-0065
  • 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 0133-0065 available by request