N-(4-methoxy-2,5-dimethylphenyl)-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Chemical Structure Depiction of
N-(4-methoxy-2,5-dimethylphenyl)-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
N-(4-methoxy-2,5-dimethylphenyl)-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Compound characteristics
| Compound ID: | J031-0558 |
| Compound Name: | N-(4-methoxy-2,5-dimethylphenyl)-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide |
| Molecular Weight: | 341.41 |
| Molecular Formula: | C20 H23 N O4 |
| Smiles: | Cc1cc2c(cc1C(Nc1cc(C)c(cc1C)OC)=O)OCCCO2 |
| Stereo: | ACHIRAL |
| logP: | 3.2908 |
| logD: | 3.2907 |
| logSw: | -3.5551 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.416 |
| InChI Key: | GWCVCACQCPMMGL-UHFFFAOYSA-N |