4476-2965 Screening compound: 4-PHENYL-6-(TRIFLUOROMETHYL)-2(1H)-PYRIMIDINONE

4476-2965 Screening compound: 4-PHENYL-6-(TRIFLUOROMETHYL)-2(1H)-PYRIMIDINONE
4476-2965 Screening compound: 4-PHENYL-6-(TRIFLUOROMETHYL)-2(1H)-PYRIMIDINONE alternative view

Chemical Structure Depiction of ChemDiv screening compound 4476-2965
4-PHENYL-6-(TRIFLUOROMETHYL)-2(1H)-PYRIMIDINONE

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

4476-2965

Molecular Formula

C11H7F3N2O (C11 H7 F3 N2 O)

Compound Name

4-PHENYL-6-(TRIFLUOROMETHYL)-2(1H)-PYRIMIDINONE

IUPAC name

n/a

SMILES

O=C(NC(C(F)(F)F)=C1)N=C1c1ccccc1

InChI

InChI=1S/C11H7F3N2O/c12-11(13,14)9-6-8(15-10(17)16-9)7-4-2-1-3-5-7/h1-6H,(H,15,16,17)

InChI Key

XQQSFWKOCNZPPF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03017363

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

240.18

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.542

Distribution Coefficient, logD

-1.415

Water Solubility, LogSw

-3.00

Polar Surface Area

33.161

Acid Dissociation Constant (pKa)

5.74

Base Dissociation Constant (pKb)

0.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

1.00

4476-2965 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Cardiovascular Library (22201 compounds)

Fragments Library (11262 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cardiovascular
Agro:
  • Agro
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with 4476-2965 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4476-2965?
Check Price and Availability of 4476-2965, 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 4476-2965 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4476-2965
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4476-2965
  • 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 4476-2965 available by request