N-(2,5-dimethoxyphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Chemical Structure Depiction of
N-(2,5-dimethoxyphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
N-(2,5-dimethoxyphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Compound characteristics
| Compound ID: | J031-0474 |
| Compound Name: | N-(2,5-dimethoxyphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide |
| Molecular Weight: | 329.35 |
| Molecular Formula: | C18 H19 N O5 |
| Smiles: | COc1ccc(c(c1)NC(c1ccc2c(c1)OCCCO2)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.4335 |
| logD: | 2.4313 |
| logSw: | -2.9738 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.96 |
| InChI Key: | LHRDFZQDOJKHIX-UHFFFAOYSA-N |