D029-0021 Screening compound: methyl 1-methyl-2,4-dioxo-5-phenyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-7-carboxylate

D029-0021 Screening compound: methyl 1-methyl-2,4-dioxo-5-phenyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-7-carboxylate
D029-0021 Screening compound: methyl 1-methyl-2,4-dioxo-5-phenyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-7-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound D029-0021
methyl 1-methyl-2,4-dioxo-5-phenyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-7-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

D029-0021

Molecular Formula

C16H13N3O4 (C16 H13 N3 O4)

Compound Name

methyl 1-methyl-2,4-dioxo-5-phenyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-7-carboxylate

IUPAC name

methyl 1-methyl-24-dioxo-5-phenyl-1H2H3H4H-pyrido[23-d]pyrimidine-7-carboxylate

SMILES

CN(c1nc(C(OC)=O)cc(-c2ccccc2)c1C(N1)=O)C1=O

InChI

InChI=1S/C16H13N3O4/c1-19-13-12(14(20)18-16(19)22)10(9-6-4-3-5-7-9)8-11(17-13)15(21)23-2/h3-8H,1-2H3,(H,18,20,22)

InChI Key

RJVBFVLZAZWAPU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14811078

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

311.3

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.459

Distribution Coefficient, logD

2.456

Water Solubility, LogSw

-3.38

Polar Surface Area

71.056

Acid Dissociation Constant (pKa)

9.66

Base Dissociation Constant (pKb)

-1.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

D029-0021 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with D029-0021 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D029-0021?
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What is the minimum amount of D029-0021 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D029-0021
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D029-0021
  • 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 D029-0021 available by request