J026-3884 Screening compound: ethyl 3-{[(5-chloro-2-methoxyphenyl)carbamoyl]methyl}-1,7-dimethyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-5-carboxylate

J026-3884 Screening compound: ethyl 3-{[(5-chloro-2-methoxyphenyl)carbamoyl]methyl}-1,7-dimethyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-5-carboxylate
J026-3884 Screening compound: ethyl 3-{[(5-chloro-2-methoxyphenyl)carbamoyl]methyl}-1,7-dimethyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound J026-3884
ethyl 3-{[(5-chloro-2-methoxyphenyl)carbamoyl]methyl}-1,7-dimethyl-2,4-dioxo-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

J026-3884

Molecular Formula

C21H21ClN4O6 (C21 H21 ClN4 O6)

Compound Name

ethyl 3-{[(5-chloro-2-methoxyphenyl)carbamoyl]methyl}-1,7-dimethyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-5-carboxylate

IUPAC name

ethyl 3-{[(5-chloro-2-methoxyphenyl)carbamoyl]methyl}-17-dimethyl-24-dioxo-1H2H3H4H-pyrido[23-d]pyrimidine-5-carboxylate

SMILES

CCOC(c1cc(C)nc(N(C)C(N2CC(Nc(cc(cc3)Cl)c3OC)=O)=O)c1C2=O)=O

InChI

InChI=1S/C21H21ClN4O6/c1-5-32-20(29)13-8-11(2)23-18-17(13)19(28)26(21(30)25(18)3)10-16(27)24-14-9-12(22)6-7-15(14)31-4/h6-9H,5,10H2,1-4H3,(H,24,27)

InChI Key

LHPHEJDISFPKDU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12965538

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.87

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.031

Distribution Coefficient, logD

3.029

Water Solubility, LogSw

-3.68

Polar Surface Area

91.845

Acid Dissociation Constant (pKa)

9.83

Base Dissociation Constant (pKb)

2.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

J026-3884 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Others
  • Kinases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with J026-3884 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J026-3884?
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What is the minimum amount of J026-3884 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J026-3884
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J026-3884
  • 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 J026-3884 available by request