V003-7079 Screening compound: 3-[1-(2,5-difluorophenyl)-5-methyl-1H-pyrazol-3-yl]-9-[(2,5-difluorophenyl)methoxy]-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one

V003-7079 Screening compound: 3-[1-(2,5-difluorophenyl)-5-methyl-1H-pyrazol-3-yl]-9-[(2,5-difluorophenyl)methoxy]-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
V003-7079 Screening compound: 3-[1-(2,5-difluorophenyl)-5-methyl-1H-pyrazol-3-yl]-9-[(2,5-difluorophenyl)methoxy]-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-7079
3-[1-(2,5-difluorophenyl)-5-methyl-1H-pyrazol-3-yl]-9-[(2,5-difluorophenyl)methoxy]-2-methyl-4H-pyrido[1,2-a]pyrimidin-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

V003-7079

Molecular Formula

C26H18F4N4O2 (C26 H18 F4 N4 O2)

Compound Name

3-[1-(2,5-difluorophenyl)-5-methyl-1H-pyrazol-3-yl]-9-[(2,5-difluorophenyl)methoxy]-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one

IUPAC name

3-[1-(25-difluorophenyl)-5-methyl-1H-pyrazol-3-yl]-9-[(25-difluorophenyl)methoxy]-2-methyl-4H-pyrido[12-a]pyrimidin-4-one

SMILES

Cc1cc(C2=C(C)N=C(C(OCc(cc(cc3)F)c3F)=CC=C3)N3C2=O)nn1-c(cc(cc1)F)c1F

InChI

InChI=1S/C26H18F4N4O2/c1-14-10-21(32-34(14)22-12-18(28)6-8-20(22)30)24-15(2)31-25-23(4-3-9-33(25)26(24)35)36-13-16-11-17(27)5-7-19(16)29/h3-12H,13H2,1-2H3

InChI Key

GNJNURWXHIXACH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19855895

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

494.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.591

Distribution Coefficient, logD

4.587

Water Solubility, LogSw

-4.47

Polar Surface Area

44.568

Acid Dissociation Constant (pKa)

26.94

Base Dissociation Constant (pKb)

5.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.50

V003-7079 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V003-7079 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-7079?
Check Price and Availability of V003-7079, 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 V003-7079 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-7079
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-7079
  • 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 V003-7079 available by request