2954-0002 Screening compound: 1-(2-hydroxyphenyl)-2,6-dimethyl-5-phenyl-1,4-dihydropyrimidin-4-one

2954-0002 Screening compound: 1-(2-hydroxyphenyl)-2,6-dimethyl-5-phenyl-1,4-dihydropyrimidin-4-one
2954-0002 Screening compound: 1-(2-hydroxyphenyl)-2,6-dimethyl-5-phenyl-1,4-dihydropyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 2954-0002
1-(2-hydroxyphenyl)-2,6-dimethyl-5-phenyl-1,4-dihydropyrimidin-4-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

2954-0002

Molecular Formula

C18H16N2O2 (C18 H16 N2 O2)

Compound Name

1-(2-hydroxyphenyl)-2,6-dimethyl-5-phenyl-1,4-dihydropyrimidin-4-one

IUPAC name

1-(2-hydroxyphenyl)-26-dimethyl-5-phenyl-14-dihydropyrimidin-4-one

SMILES

CC(N(C(C)=N1)c(cccc2)c2O)=C(c2ccccc2)C1=O

InChI

InChI=1S/C18H16N2O2/c1-12-17(14-8-4-3-5-9-14)18(22)19-13(2)20(12)15-10-6-7-11-16(15)21/h3-11,21H,1-2H3

InChI Key

LTLMIWJDEMUFDE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01455712

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

292.34

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.864

Distribution Coefficient, logD

1.398

Water Solubility, LogSw

-3.15

Polar Surface Area

39.988

Acid Dissociation Constant (pKa)

10.35

Base Dissociation Constant (pKb)

8.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

2954-0002 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

Fragments Library (11262 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments
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 2954-0002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2954-0002?
Check Price and Availability of 2954-0002, 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 2954-0002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2954-0002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2954-0002
  • 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 2954-0002 available by request