3-(4-{[5-methoxy-1-(propan-2-yl)-1H-indol-3-yl]methyl}-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N,N-dimethylpropanamide
Chemical Structure Depiction of
3-(4-{[5-methoxy-1-(propan-2-yl)-1H-indol-3-yl]methyl}-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N,N-dimethylpropanamide
3-(4-{[5-methoxy-1-(propan-2-yl)-1H-indol-3-yl]methyl}-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N,N-dimethylpropanamide
Compound characteristics
| Compound ID: | S629-1211 |
| Compound Name: | 3-(4-{[5-methoxy-1-(propan-2-yl)-1H-indol-3-yl]methyl}-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N,N-dimethylpropanamide |
| Molecular Weight: | 449.59 |
| Molecular Formula: | C27 H35 N3 O3 |
| Smiles: | CC(C)n1cc(CN2CCOc3ccc(CCC(N(C)C)=O)cc3C2)c2cc(ccc12)OC |
| Stereo: | ACHIRAL |
| logP: | 3.9453 |
| logD: | -0.6632 |
| logSw: | -3.9657 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.727 |
| InChI Key: | HBHBVPGUVRDUJH-UHFFFAOYSA-N |