7-[(azepan-1-yl)methyl]-N-(3-ethoxypropyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Chemical Structure Depiction of
7-[(azepan-1-yl)methyl]-N-(3-ethoxypropyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
7-[(azepan-1-yl)methyl]-N-(3-ethoxypropyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Compound characteristics
| Compound ID: | T634-0608 |
| Compound Name: | 7-[(azepan-1-yl)methyl]-N-(3-ethoxypropyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide |
| Molecular Weight: | 389.54 |
| Molecular Formula: | C22 H35 N3 O3 |
| Smiles: | CCOCCCNC(N1CCOc2ccc(CN3CCCCCC3)cc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.315 |
| logD: | 1.7089 |
| logSw: | -3.2969 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.128 |
| InChI Key: | ISCYBYKDNATHBS-UHFFFAOYSA-N |