J026-0026 Screening compound: N-(3-chloro-4-fluorophenyl)-2-{5,7-dimethyl-2,4-dioxo-1-phenyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-3-yl}acetamide

J026-0026 Screening compound: N-(3-chloro-4-fluorophenyl)-2-{5,7-dimethyl-2,4-dioxo-1-phenyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-3-yl}acetamide
J026-0026 Screening compound: N-(3-chloro-4-fluorophenyl)-2-{5,7-dimethyl-2,4-dioxo-1-phenyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-3-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J026-0026
N-(3-chloro-4-fluorophenyl)-2-{5,7-dimethyl-2,4-dioxo-1-phenyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-3-yl}acetamide

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

J026-0026

Molecular Formula

C23H18ClFN4O3 (C23 H18 ClFN4 O3)

Compound Name

N-(3-chloro-4-fluorophenyl)-2-{5,7-dimethyl-2,4-dioxo-1-phenyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-3-yl}acetamide

IUPAC name

N-(3-chloro-4-fluorophenyl)-2-{57-dimethyl-24-dioxo-1-phenyl-1H2H3H4H-pyrido[23-d]pyrimidin-3-yl}acetamide

SMILES

Cc1cc(C)nc(N(c2ccccc2)C(N2CC(Nc(cc3)cc(Cl)c3F)=O)=O)c1C2=O

InChI

InChI=1S/C23H18ClFN4O3/c1-13-10-14(2)26-21-20(13)22(31)28(23(32)29(21)16-6-4-3-5-7-16)12-19(30)27-15-8-9-18(25)17(24)11-15/h3-11H,12H2,1-2H3,(H,27,30)

InChI Key

JVVJGTODKGCBPV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09779465

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.87

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.371

Distribution Coefficient, logD

4.368

Water Solubility, LogSw

-4.70

Polar Surface Area

63.510

Acid Dissociation Constant (pKa)

9.57

Base Dissociation Constant (pKb)

3.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

J026-0026 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with J026-0026 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J026-0026?
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What is the minimum amount of J026-0026 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J026-0026
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J026-0026
  • 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 J026-0026 available by request