8-methyl-N-(2-phenylethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Chemical Structure Depiction of
8-methyl-N-(2-phenylethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
8-methyl-N-(2-phenylethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Compound characteristics
| Compound ID: | J031-0551 |
| Compound Name: | 8-methyl-N-(2-phenylethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide |
| Molecular Weight: | 311.38 |
| Molecular Formula: | C19 H21 N O3 |
| Smiles: | Cc1cc2c(cc1C(NCCc1ccccc1)=O)OCCCO2 |
| Stereo: | ACHIRAL |
| logP: | 2.7738 |
| logD: | 2.7738 |
| logSw: | -3.2763 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.647 |
| InChI Key: | GMTUFNIPCCJEJY-UHFFFAOYSA-N |