N-(5-chloro-2-methoxyphenyl)-8-methoxy-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-8-methoxy-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
N-(5-chloro-2-methoxyphenyl)-8-methoxy-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Compound characteristics
| Compound ID: | J031-2394 |
| Compound Name: | N-(5-chloro-2-methoxyphenyl)-8-methoxy-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide |
| Molecular Weight: | 363.8 |
| Molecular Formula: | C18 H18 Cl N O5 |
| Smiles: | COc1cc2c(cc1C(Nc1cc(ccc1OC)[Cl])=O)OCCCO2 |
| Stereo: | ACHIRAL |
| logP: | 3.2109 |
| logD: | 2.9633 |
| logSw: | -3.5517 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.047 |
| InChI Key: | UCBFKYDCMLOXEZ-UHFFFAOYSA-N |