N,N-dimethyl-3-(4-{[1-(propan-2-yl)-1H-indol-3-yl]methyl}-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)propanamide
Chemical Structure Depiction of
N,N-dimethyl-3-(4-{[1-(propan-2-yl)-1H-indol-3-yl]methyl}-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)propanamide
N,N-dimethyl-3-(4-{[1-(propan-2-yl)-1H-indol-3-yl]methyl}-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)propanamide
Compound characteristics
| Compound ID: | S629-1209 |
| Compound Name: | N,N-dimethyl-3-(4-{[1-(propan-2-yl)-1H-indol-3-yl]methyl}-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)propanamide |
| Molecular Weight: | 419.57 |
| Molecular Formula: | C26 H33 N3 O2 |
| Smiles: | CC(C)n1cc(CN2CCOc3ccc(CCC(N(C)C)=O)cc3C2)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.8695 |
| logD: | -1 |
| logSw: | -3.8493 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.1833 |
| InChI Key: | CLANIWDBACMUEV-UHFFFAOYSA-N |