methyl 4-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Chemical Structure Depiction of
methyl 4-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
methyl 4-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | 8018-5396 |
| Compound Name: | methyl 4-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate |
| Molecular Weight: | 332.31 |
| Molecular Formula: | C16 H16 N2 O6 |
| Smiles: | CC1=C(C(CC(N1)=O)C(Nc1ccc2c(c1)OCO2)=O)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7035 |
| logD: | -0.1375 |
| logSw: | -1.7864 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.091 |
| InChI Key: | DDMCMTRDJIBBRQ-JTQLQIEISA-N |