8-methoxy-N-(naphthalen-1-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Chemical Structure Depiction of
8-methoxy-N-(naphthalen-1-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
8-methoxy-N-(naphthalen-1-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Compound characteristics
| Compound ID: | J031-0624 |
| Compound Name: | 8-methoxy-N-(naphthalen-1-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide |
| Molecular Weight: | 349.38 |
| Molecular Formula: | C21 H19 N O4 |
| Smiles: | COc1cc2c(cc1C(Nc1cccc3ccccc13)=O)OCCCO2 |
| Stereo: | ACHIRAL |
| logP: | 3.527 |
| logD: | 3.5262 |
| logSw: | -3.7533 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.145 |
| InChI Key: | OPBRSKHMWMGXRY-UHFFFAOYSA-N |