N,N-dimethyl-4-[(1-methyl-1H-indol-3-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-amine
Chemical Structure Depiction of
N,N-dimethyl-4-[(1-methyl-1H-indol-3-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-amine
N,N-dimethyl-4-[(1-methyl-1H-indol-3-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-amine
Compound characteristics
| Compound ID: | S555-1980 |
| Compound Name: | N,N-dimethyl-4-[(1-methyl-1H-indol-3-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-amine |
| Molecular Weight: | 335.45 |
| Molecular Formula: | C21 H25 N3 O |
| Smiles: | CN(C)c1ccc2c(CN(CCO2)Cc2cn(C)c3ccccc23)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.8044 |
| logD: | -1.0122 |
| logSw: | -3.8244 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 17.2794 |
| InChI Key: | XZDCBSVZFRCRGG-UHFFFAOYSA-N |