F041-0630 Screening compound: 5-ethoxy-6-ethyl-1-methyl-3-[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione

F041-0630 Screening compound: 5-ethoxy-6-ethyl-1-methyl-3-[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione
F041-0630 Screening compound: 5-ethoxy-6-ethyl-1-methyl-3-[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound F041-0630
5-ethoxy-6-ethyl-1-methyl-3-[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]-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

F041-0630

Molecular Formula

C23H26N4O4 (C23 H26 N4 O4)

Compound Name

5-ethoxy-6-ethyl-1-methyl-3-[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione

IUPAC name

5-ethoxy-6-ethyl-1-methyl-3-[2-oxo-2-(1234-tetrahydroquinolin-1-yl)ethyl]-1H2H3H4H-pyrido[23-d]pyrimidine-24-dione

SMILES

CCc(cnc(N(C)C(N1CC(N(CCC2)c3c2cccc3)=O)=O)c2C1=O)c2OCC

InChI

InChI=1S/C23H26N4O4/c1-4-15-13-24-21-19(20(15)31-5-2)22(29)27(23(30)25(21)3)14-18(28)26-12-8-10-16-9-6-7-11-17(16)26/h6-7,9,11,13H,4-5,8,10,12,14H2,1-3H3

InChI Key

JAJSCEMIBJZGFH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08534851

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.48

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

3.068

Distribution Coefficient, logD

3.068

Water Solubility, LogSw

-3.19

Polar Surface Area

64.078

Acid Dissociation Constant (pKa)

20.76

Base Dissociation Constant (pKb)

1.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

F041-0630 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with F041-0630 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F041-0630?
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What is the minimum amount of F041-0630 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F041-0630
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F041-0630
  • 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 F041-0630 available by request