D029-0038 Screening compound: methyl 1,5-dimethyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-7-carboxylate

D029-0038 Screening compound: methyl 1,5-dimethyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-7-carboxylate
D029-0038 Screening compound: methyl 1,5-dimethyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-7-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound D029-0038
methyl 1,5-dimethyl-2,4-dioxo-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

D029-0038

Molecular Formula

C11H11N3O4 (C11 H11 N3 O4)

Compound Name

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

IUPAC name

methyl 15-dimethyl-24-dioxo-1H2H3H4H-pyrido[23-d]pyrimidine-7-carboxylate

SMILES

Cc1c(C(NC(N2C)=O)=O)c2nc(C(OC)=O)c1

InChI

InChI=1S/C11H11N3O4/c1-5-4-6(10(16)18-3)12-8-7(5)9(15)13-11(17)14(8)2/h4H,1-3H3,(H,13,15,17)

InChI Key

VOFYFBKFZFWREG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08069989

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

249.23

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.022

Distribution Coefficient, logD

1.002

Water Solubility, LogSw

-2.13

Polar Surface Area

71.328

Acid Dissociation Constant (pKa)

8.74

Base Dissociation Constant (pKb)

-0.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

D029-0038 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Cardiovascular Library (22201 compounds)

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with D029-0038 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D029-0038?
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What is the minimum amount of D029-0038 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D029-0038
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D029-0038
  • 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 D029-0038 available by request