N-[(2H-1,3-benzodioxol-5-yl)methyl]-7-methyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-7-methyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-7-methyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | Y020-9128 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-7-methyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide |
| Molecular Weight: | 354.36 |
| Molecular Formula: | C19 H18 N2 O5 |
| Smiles: | CC1CC2=C(C=C(C(NCc3ccc4c(c3)OCO4)=O)C(N2)=O)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8274 |
| logD: | -2.3416 |
| logSw: | -2.4034 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.864 |
| InChI Key: | QGGHQHDWPNIGNE-JTQLQIEISA-N |