N-cyclopropyl-3-{4-[(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}propanamide
Chemical Structure Depiction of
N-cyclopropyl-3-{4-[(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}propanamide
N-cyclopropyl-3-{4-[(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}propanamide
Compound characteristics
| Compound ID: | S629-1934 |
| Compound Name: | N-cyclopropyl-3-{4-[(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}propanamide |
| Molecular Weight: | 397.47 |
| Molecular Formula: | C22 H27 N3 O4 |
| Smiles: | Cc1c(CC(N2CCOc3ccc(CCC(NC4CC4)=O)cc3C2)=O)c(C)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.2254 |
| logD: | 2.2254 |
| logSw: | -2.8044 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.598 |
| InChI Key: | AGGLNOXHNZCIAP-UHFFFAOYSA-N |