F041-0016 Screening compound: 3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-5-methoxy-1,6-dimethyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione

F041-0016 Screening compound: 3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-5-methoxy-1,6-dimethyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione
F041-0016 Screening compound: 3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-5-methoxy-1,6-dimethyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound F041-0016
3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-5-methoxy-1,6-dimethyl-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

F041-0016

Molecular Formula

C24H28N4O4 (C24 H28 N4 O4)

Compound Name

3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-5-methoxy-1,6-dimethyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione

IUPAC name

3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-5-methoxy-16-dimethyl-1H2H3H4H-pyrido[23-d]pyrimidine-24-dione

SMILES

Cc(cnc(N(C)C(N1CC(N2CCC(Cc3ccccc3)CC2)=O)=O)c2C1=O)c2OC

InChI

InChI=1S/C24H28N4O4/c1-16-14-25-22-20(21(16)32-3)23(30)28(24(31)26(22)2)15-19(29)27-11-9-18(10-12-27)13-17-7-5-4-6-8-17/h4-8,14,18H,9-13,15H2,1-3H3

InChI Key

KHJVKTASFJKUJE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09239943

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.51

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.047

Distribution Coefficient, logD

3.047

Water Solubility, LogSw

-2.96

Polar Surface Area

65.563

Acid Dissociation Constant (pKa)

22.34

Base Dissociation Constant (pKb)

2.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.70

F041-0016 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F041-0016 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of F041-0016 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F041-0016
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F041-0016
  • 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 F041-0016 available by request