V004-3248 Screening compound: 9-[(4-tert-butylphenyl)methoxy]-2-methyl-3-[5-methyl-1-(3-methylphenyl)-1H-pyrazol-3-yl]-4H-pyrido[1,2-a]pyrimidin-4-one

V004-3248 Screening compound: 9-[(4-tert-butylphenyl)methoxy]-2-methyl-3-[5-methyl-1-(3-methylphenyl)-1H-pyrazol-3-yl]-4H-pyrido[1,2-a]pyrimidin-4-one
V004-3248 Screening compound: 9-[(4-tert-butylphenyl)methoxy]-2-methyl-3-[5-methyl-1-(3-methylphenyl)-1H-pyrazol-3-yl]-4H-pyrido[1,2-a]pyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-3248
9-[(4-tert-butylphenyl)methoxy]-2-methyl-3-[5-methyl-1-(3-methylphenyl)-1H-pyrazol-3-yl]-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

V004-3248

Molecular Formula

C31H32N4O2 (C31 H32 N4 O2)

Compound Name

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

IUPAC name

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

SMILES

CC(C)(C)c1ccc(COC(C2=NC(C)=C3c(cc4C)nn4-c4cc(C)ccc4)=CC=CN2C3=O)cc1

InChI

InChI=1S/C31H32N4O2/c1-20-9-7-10-25(17-20)35-21(2)18-26(33-35)28-22(3)32-29-27(11-8-16-34(29)30(28)36)37-19-23-12-14-24(15-13-23)31(4,5)6/h7-18H,19H2,1-6H3

InChI Key

AREWRCANLADQAK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19855856

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

492.62

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.413

Distribution Coefficient, logD

6.409

Water Solubility, LogSw

-5.64

Polar Surface Area

44.868

Acid Dissociation Constant (pKa)

27.08

Base Dissociation Constant (pKb)

5.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.80

V004-3248 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with V004-3248 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-3248?
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What is the minimum amount of V004-3248 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-3248
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-3248
  • 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 V004-3248 available by request