N-[(3-hydroxy-4-methoxyphenyl)methyl]-4,7-dimethoxy-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[(3-hydroxy-4-methoxyphenyl)methyl]-4,7-dimethoxy-2H-1,3-benzodioxole-5-carboxamide
N-[(3-hydroxy-4-methoxyphenyl)methyl]-4,7-dimethoxy-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | 8020-5540 |
| Compound Name: | N-[(3-hydroxy-4-methoxyphenyl)methyl]-4,7-dimethoxy-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 361.35 |
| Molecular Formula: | C18 H19 N O7 |
| Smiles: | COc1ccc(CNC(c2cc(c3c(c2OC)OCO3)OC)=O)cc1O |
| Stereo: | ACHIRAL |
| logP: | 2.3377 |
| logD: | 2.3317 |
| logSw: | -2.9708 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.662 |
| InChI Key: | KXBMETNABJRJED-UHFFFAOYSA-N |