5,6-Dihydro-2(1H)-pyridinone; N-3-[(3-Methoxy-4,5-methylenedioxyphenyl)propanoyl]
AlkaPlorer ID: AK067885
Synonym: 5,6-Dihydro-N-3-[(3-methoxy-4,5-methylenedioxyphenyl)propanoyl]-2(1H)-pyridinone, 5,6-Dihydro-1-[3-(7-methoxy-1,3-benzodioxol-5-yl)-1-oxopropyl]-2(1H)-pyridinone
IUPAC Name: 1-[3-(7-methoxy-1,3-benzodioxol-5-yl)propanoyl]-2,3-dihydropyridin-6-one
Structure
SMILES: COC1=CC(CCC(=O)N2CCC=CC2=O)=CC2=C1OCO2
InChI: InChI=1S/C16H17NO5/c1-20-12-8-11(9-13-16(12)22-10-21-13)5-6-15(19)17-7-3-2-4-14(17)18/h2,4,8-9H,3,5-7,10H2,1H3
InChIKey: FVDNFBPSWOROKM-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 303.3140000000001
TPSA？: 65.07000000000001
MolLogP？: 1.6716
Number of H-Donors: 0
Number of H-Acceptors: 5
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | A549 | ED50 | 5.76 | ug ml-1 | 10.1021/np50072a030 |
| Homo sapiens | HT-29 | ED50 | 3.8 | ug ml-1 | 10.1021/np50072a030 |
| Homo sapiens | KB | ED50 | 4.99 | ug ml-1 | 10.1021/np50072a030 |
| Mus musculus | P388 | ED50 | 2.21 | ug ml-1 | 10.1021/np50072a030 |