rel-(5aR,9aR)-1-methyldecahydropyrido[3,4-e][1,4]oxazepine
Chemical Structure Depiction of
rel-(5aR,9aR)-1-methyldecahydropyrido[3,4-e][1,4]oxazepine
rel-(5aR,9aR)-1-methyldecahydropyrido[3,4-e][1,4]oxazepine
Compound characteristics
| Compound ID: | S232-0248 |
| Compound Name: | rel-(5aR,9aR)-1-methyldecahydropyrido[3,4-e][1,4]oxazepine |
| Molecular Weight: | 206.71 |
| Molecular Formula: | C9 H18 N2 O |
| Salt: | HCl |
| Smiles: | CN1CCOC[C@H]2CCNC[C@@H]12 |
| Stereo: | RELATIVE |
| logP: | -0.8611 |
| logD: | -3.1968 |
| logSw: | 0.3127 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 23.9628 |
| InChI Key: | MANMWXSZKMPCNX-DTWKUNHWSA-N |