Y070-0376 Screening compound: 4-oxo-2-{[3-(trifluoromethyl)phenyl]amino}-4H-pyrido[1,2-a]pyrimidine-3-carbaldehyde

Y070-0376 Screening compound: 4-oxo-2-{[3-(trifluoromethyl)phenyl]amino}-4H-pyrido[1,2-a]pyrimidine-3-carbaldehyde
Y070-0376 Screening compound: 4-oxo-2-{[3-(trifluoromethyl)phenyl]amino}-4H-pyrido[1,2-a]pyrimidine-3-carbaldehyde alternative view

Chemical Structure Depiction of ChemDiv screening compound Y070-0376
4-oxo-2-{[3-(trifluoromethyl)phenyl]amino}-4H-pyrido[1,2-a]pyrimidine-3-carbaldehyde

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

Y070-0376

Molecular Formula

C16H10F3N3O2 (C16 H10 F3 N3 O2)

Compound Name

4-oxo-2-{[3-(trifluoromethyl)phenyl]amino}-4H-pyrido[1,2-a]pyrimidine-3-carbaldehyde

IUPAC name

4-oxo-2-{[3-(trifluoromethyl)phenyl]amino}-4H-pyrido[12-a]pyrimidine-3-carbaldehyde

SMILES

O=CC1=C(Nc2cccc(C(F)(F)F)c2)N=C(C=CC=C2)N2C1=O

InChI

InChI=1S/C16H10F3N3O2/c17-16(18,19)10-4-3-5-11(8-10)20-14-12(9-23)15(24)22-7-2-1-6-13(22)21-14/h1-9,20H

InChI Key

KKTRDLDCCQNKIF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01072121

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

333.27

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.661

Distribution Coefficient, logD

1.141

Water Solubility, LogSw

-3.12

Polar Surface Area

47.818

Acid Dissociation Constant (pKa)

5.89

Base Dissociation Constant (pKb)

1.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.30

Y070-0376 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Antiviral Annotated Library (21441 compounds)

Human Receptors Annotated Library (5376 compounds)

KRAS-Targeted Library (16000 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Agro:
  • Agro
Targets:
  • Kinases
Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with Y070-0376 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y070-0376?
Check Price and Availability of Y070-0376, 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 Y070-0376 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y070-0376
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y070-0376
  • 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 Y070-0376 available by request