8-methoxy-N-(4-propoxyphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Chemical Structure Depiction of
8-methoxy-N-(4-propoxyphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
8-methoxy-N-(4-propoxyphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Compound characteristics
| Compound ID: | J031-1961 |
| Compound Name: | 8-methoxy-N-(4-propoxyphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide |
| Molecular Weight: | 357.41 |
| Molecular Formula: | C20 H23 N O5 |
| Smiles: | CCCOc1ccc(cc1)NC(c1cc2c(cc1OC)OCCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7191 |
| logD: | 3.7188 |
| logSw: | -3.9594 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.532 |
| InChI Key: | LENGUUFZGISSOY-UHFFFAOYSA-N |