2332-2103 Screening compound: methyl 7-methyl-5-(3-nitrophenyl)-2,4-dioxo-1H,2H,3H,4H,5H,8H-pyrido[2,3-d]pyrimidine-6-carboxylate

2332-2103 Screening compound: methyl 7-methyl-5-(3-nitrophenyl)-2,4-dioxo-1H,2H,3H,4H,5H,8H-pyrido[2,3-d]pyrimidine-6-carboxylate
2332-2103 Screening compound: methyl 7-methyl-5-(3-nitrophenyl)-2,4-dioxo-1H,2H,3H,4H,5H,8H-pyrido[2,3-d]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2332-2103
methyl 7-methyl-5-(3-nitrophenyl)-2,4-dioxo-1H,2H,3H,4H,5H,8H-pyrido[2,3-d]pyrimidine-6-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

2332-2103

Molecular Formula

C16H14N4O6 (C16 H14 N4 O6)

Compound Name

methyl 7-methyl-5-(3-nitrophenyl)-2,4-dioxo-1H,2H,3H,4H,5H,8H-pyrido[2,3-d]pyrimidine-6-carboxylate

IUPAC name

methyl 7-methyl-5-(3-nitrophenyl)-24-dioxo-1H2H3H4H5H8H-pyrido[23-d]pyrimidine-6-carboxylate

SMILES

CC(NC(NC(N1)=O)=C(C2c3cccc([N+]([O-])=O)c3)C1=O)=C2C(OC)=O

InChI

InChI=1S/C16H14N4O6/c1-7-10(15(22)26-2)11(8-4-3-5-9(6-8)20(24)25)12-13(17-7)18-16(23)19-14(12)21/h3-6,11H,1-2H3,(H3,17,18,19,21,23)/t11-/m0/s1

InChI Key

CORKFCUEWUYNGO-NSHDSACASA-N

MDL Number (MFCD)

MFCD01538187

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.31

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.938

Distribution Coefficient, logD

-0.923

Water Solubility, LogSw

-2.24

Polar Surface Area

112.959

Acid Dissociation Constant (pKa)

5.54

Base Dissociation Constant (pKb)

-7.86

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

18.80

2332-2103 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 2332-2103 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2332-2103?
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What is the minimum amount of 2332-2103 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2332-2103
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2332-2103
  • 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 2332-2103 available by request