N-(4-acetylphenyl)-8-methoxy-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Chemical Structure Depiction of
N-(4-acetylphenyl)-8-methoxy-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
N-(4-acetylphenyl)-8-methoxy-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Compound characteristics
| Compound ID: | J031-1943 |
| Compound Name: | N-(4-acetylphenyl)-8-methoxy-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide |
| Molecular Weight: | 341.36 |
| Molecular Formula: | C19 H19 N O5 |
| Smiles: | CC(c1ccc(cc1)NC(c1cc2c(cc1OC)OCCCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3019 |
| logD: | 2.2827 |
| logSw: | -3.0854 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.941 |
| InChI Key: | IHHHJZVHGZRHMQ-UHFFFAOYSA-N |