J026-0786 Screening compound: 3-[(2,5-dimethylphenyl)methyl]-1-(2-methoxyphenyl)-5,7-dimethyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione

J026-0786 Screening compound: 3-[(2,5-dimethylphenyl)methyl]-1-(2-methoxyphenyl)-5,7-dimethyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione
J026-0786 Screening compound: 3-[(2,5-dimethylphenyl)methyl]-1-(2-methoxyphenyl)-5,7-dimethyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound J026-0786
3-[(2,5-dimethylphenyl)methyl]-1-(2-methoxyphenyl)-5,7-dimethyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione

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

J026-0786

Molecular Formula

C25H25N3O3 (C25 H25 N3 O3)

Compound Name

3-[(2,5-dimethylphenyl)methyl]-1-(2-methoxyphenyl)-5,7-dimethyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione

IUPAC name

3-[(25-dimethylphenyl)methyl]-1-(2-methoxyphenyl)-57-dimethyl-1H2H3H4H-pyrido[23-d]pyrimidine-24-dione

SMILES

Cc1cc(CN(C(c2c(C)cc(C)nc2N2c(cccc3)c3OC)=O)C2=O)c(C)cc1

InChI

InChI=1S/C25H25N3O3/c1-15-10-11-16(2)19(12-15)14-27-24(29)22-17(3)13-18(4)26-23(22)28(25(27)30)20-8-6-7-9-21(20)31-5/h6-13H,14H2,1-5H3

InChI Key

WQRIIDKIPOWRAZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09779603

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.262

Distribution Coefficient, logD

5.253

Water Solubility, LogSw

-5.09

Polar Surface Area

47.690

Acid Dissociation Constant (pKa)

26.64

Base Dissociation Constant (pKb)

5.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

J026-0786 in Drug Discovery

Included in Screening Libraries

GABA Library (7115 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Eye
  • Nervous system
  • Cardiovascular
Targets:
  • GPCR
  • Ion Channels
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with J026-0786 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of J026-0786 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J026-0786
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J026-0786
  • 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 J026-0786 available by request