8-methoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Chemical Structure Depiction of
8-methoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
8-methoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Compound characteristics
| Compound ID: | J031-0580 |
| Compound Name: | 8-methoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide |
| Molecular Weight: | 353.42 |
| Molecular Formula: | C21 H23 N O4 |
| Smiles: | COc1cc2c(cc1C(NC1CCCc3ccccc13)=O)OCCCO2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.727 |
| logD: | 3.7265 |
| logSw: | -3.9195 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.28 |
| InChI Key: | RIYHQKYLBYJRRD-KRWDZBQOSA-N |