J026-4326 Screening compound: 3-[2-(1,2-dimethyl-1H-indol-3-yl)-2-oxoethyl]-1,7-dimethyl-5-(piperidine-1-carbonyl)-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione

J026-4326 Screening compound: 3-[2-(1,2-dimethyl-1H-indol-3-yl)-2-oxoethyl]-1,7-dimethyl-5-(piperidine-1-carbonyl)-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione
J026-4326 Screening compound: 3-[2-(1,2-dimethyl-1H-indol-3-yl)-2-oxoethyl]-1,7-dimethyl-5-(piperidine-1-carbonyl)-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound J026-4326
3-[2-(1,2-dimethyl-1H-indol-3-yl)-2-oxoethyl]-1,7-dimethyl-5-(piperidine-1-carbonyl)-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione

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

J026-4326

Molecular Formula

C27H29N5O4 (C27 H29 N5 O4)

Compound Name

3-[2-(1,2-dimethyl-1H-indol-3-yl)-2-oxoethyl]-1,7-dimethyl-5-(piperidine-1-carbonyl)-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione

IUPAC name

3-[2-(12-dimethyl-1H-indol-3-yl)-2-oxoethyl]-17-dimethyl-5-(piperidine-1-carbonyl)-1H2H3H4H-pyrido[23-d]pyrimidine-24-dione

SMILES

Cc1c(C(CN(C(c2c(N3C)nc(C)cc2C(N2CCCCC2)=O)=O)C3=O)=O)c(cccc2)c2n1C

InChI

InChI=1S/C27H29N5O4/c1-16-14-19(25(34)31-12-8-5-9-13-31)23-24(28-16)30(4)27(36)32(26(23)35)15-21(33)22-17(2)29(3)20-11-7-6-10-18(20)22/h6-7,10-11,14H,5,8-9,12-13,15H2,1-4H3

InChI Key

FLJNJXRDFVVBLG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12965550

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

487.56

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.801

Distribution Coefficient, logD

2.801

Water Solubility, LogSw

-3.09

Polar Surface Area

73.187

Acid Dissociation Constant (pKa)

19.03

Base Dissociation Constant (pKb)

2.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.00

J026-4326 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anticancer Library (62698 compounds)

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

Hsp90-Targeted Library (11355 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Mechanism of action:
  • PPI modulators
  • Epigenetic
  • PPI modulators
Structure:
  • Mimetics
Targets:
  • Others

References: we are preparing a list of scientific research reports with J026-4326 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J026-4326?
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What is the minimum amount of J026-4326 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J026-4326
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J026-4326
  • 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 J026-4326 available by request