J026-2046 Screening compound: methyl 3-{[(2,5-difluorophenyl)carbamoyl]methyl}-7-methyl-2,4-dioxo-1-phenyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-5-carboxylate

J026-2046 Screening compound: methyl 3-{[(2,5-difluorophenyl)carbamoyl]methyl}-7-methyl-2,4-dioxo-1-phenyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-5-carboxylate
J026-2046 Screening compound: methyl 3-{[(2,5-difluorophenyl)carbamoyl]methyl}-7-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 J026-2046
methyl 3-{[(2,5-difluorophenyl)carbamoyl]methyl}-7-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

J026-2046

Molecular Formula

C24H18F2N4O5 (C24 H18 F2 N4 O5)

Compound Name

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

IUPAC name

methyl 3-{[(25-difluorophenyl)carbamoyl]methyl}-7-methyl-24-dioxo-1-phenyl-1H2H3H4H-pyrido[23-d]pyrimidine-5-carboxylate

SMILES

Cc(cc1C(OC)=O)nc(N(c2ccccc2)C(N2CC(Nc(cc(cc3)F)c3F)=O)=O)c1C2=O

InChI

InChI=1S/C24H18F2N4O5/c1-13-10-16(23(33)35-2)20-21(27-13)30(15-6-4-3-5-7-15)24(34)29(22(20)32)12-19(31)28-18-11-14(25)8-9-17(18)26/h3-11H,12H2,1-2H3,(H,28,31)

InChI Key

SVQCGZCSXSKXEB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09779525

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

480.43

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

3.514

Distribution Coefficient, logD

3.511

Water Solubility, LogSw

-3.88

Polar Surface Area

83.986

Acid Dissociation Constant (pKa)

9.49

Base Dissociation Constant (pKb)

2.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

J026-2046 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 J026-2046 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J026-2046?
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What is the minimum amount of J026-2046 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J026-2046
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J026-2046
  • 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 J026-2046 available by request