P038-4452 Screening compound: N-(4-acetamidophenyl)-1-(4-fluorophenyl)-3-methyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of ChemDiv screening compound P038-4452
N-(4-acetamidophenyl)-1-(4-fluorophenyl)-3-methyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-6-carboxamide
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
P038-4452
Molecular Formula
C23H18FN5O4 (C23 H18 FN5 O4)
Compound Name
N-(4-acetamidophenyl)-1-(4-fluorophenyl)-3-methyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-6-carboxamide
IUPAC name
N-(4-acetamidophenyl)-1-(4-fluorophenyl)-3-methyl-24-dioxo-1H2H3H4H-pyrido[23-d]pyrimidine-6-carboxamide
SMILES
CC(Nc(cc1)ccc1NC(c(cc1C(N2C)=O)cnc1N(c(cc1)ccc1F)C2=O)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
447.43
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
2.333
Distribution Coefficient, logD
2.330
Water Solubility, LogSw
-3.00
Polar Surface Area
87.466
Acid Dissociation Constant (pKa)
9.64
Base Dissociation Constant (pKb)
1.32
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
8.70
P038-4452 in Drug Discovery
Included in Screening Libraries
Anticancer Library (62698 compounds)
Chelators targeting matrix metalloproteinases library (8930 compounds)
Hsp90-Targeted Library (11355 compounds)
Epigenetics Focused Set (26518 compounds)
Included in 1.7M Stock Database
- Cancer
- Cancer
- Digestive system
- Cardiovascular
- Cancer
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Immune system
- Proteases
References: we are preparing a list of scientific research reports with P038-4452 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)