J026-2036 Screening compound: methyl 7-methyl-3-{[(2-methylphenyl)carbamoyl]methyl}-2,4-dioxo-1-phenyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-5-carboxylate

J026-2036 Screening compound: methyl 7-methyl-3-{[(2-methylphenyl)carbamoyl]methyl}-2,4-dioxo-1-phenyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-5-carboxylate
J026-2036 Screening compound: methyl 7-methyl-3-{[(2-methylphenyl)carbamoyl]methyl}-2,4-dioxo-1-phenyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound J026-2036
methyl 7-methyl-3-{[(2-methylphenyl)carbamoyl]methyl}-2,4-dioxo-1-phenyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-5-carboxylate

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

J026-2036

Molecular Formula

C25H22N4O5 (C25 H22 N4 O5)

Compound Name

methyl 7-methyl-3-{[(2-methylphenyl)carbamoyl]methyl}-2,4-dioxo-1-phenyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-5-carboxylate

IUPAC name

methyl 7-methyl-3-{[(2-methylphenyl)carbamoyl]methyl}-24-dioxo-1-phenyl-1H2H3H4H-pyrido[23-d]pyrimidine-5-carboxylate

SMILES

Cc(cccc1)c1NC(CN(C(c(c(N1c2ccccc2)nc(C)c2)c2C(OC)=O)=O)C1=O)=O

InChI

InChI=1S/C25H22N4O5/c1-15-9-7-8-12-19(15)27-20(30)14-28-23(31)21-18(24(32)34-3)13-16(2)26-22(21)29(25(28)33)17-10-5-4-6-11-17/h4-13H,14H2,1-3H3,(H,27,30)

InChI Key

HQKQAPUPVZVREQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09779526

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.47

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.142

Distribution Coefficient, logD

3.142

Water Solubility, LogSw

-3.22

Polar Surface Area

83.986

Acid Dissociation Constant (pKa)

13.01

Base Dissociation Constant (pKb)

2.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

References: we are preparing a list of scientific research reports with J026-2036 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J026-2036?
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What is the minimum amount of J026-2036 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J026-2036
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J026-2036
  • 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 J026-2036 available by request