N-(2,5-dimethoxyphenyl)-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Chemical Structure Depiction of
N-(2,5-dimethoxyphenyl)-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
N-(2,5-dimethoxyphenyl)-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Compound characteristics
| Compound ID: | J031-0557 |
| Compound Name: | N-(2,5-dimethoxyphenyl)-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide |
| Molecular Weight: | 343.38 |
| Molecular Formula: | C19 H21 N O5 |
| Smiles: | Cc1cc2c(cc1C(Nc1cc(ccc1OC)OC)=O)OCCCO2 |
| Stereo: | ACHIRAL |
| logP: | 2.7582 |
| logD: | 2.7507 |
| logSw: | -3.219 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.96 |
| InChI Key: | VXUUNVAOFWTQHQ-UHFFFAOYSA-N |