4-[(2,3-dimethoxyphenyl)methyl]-N,N-dimethyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-amine
Chemical Structure Depiction of
4-[(2,3-dimethoxyphenyl)methyl]-N,N-dimethyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-amine
4-[(2,3-dimethoxyphenyl)methyl]-N,N-dimethyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-amine
Compound characteristics
| Compound ID: | S555-1941 |
| Compound Name: | 4-[(2,3-dimethoxyphenyl)methyl]-N,N-dimethyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-amine |
| Molecular Weight: | 342.44 |
| Molecular Formula: | C20 H26 N2 O3 |
| Smiles: | CN(C)c1ccc2c(CN(CCO2)Cc2cccc(c2OC)OC)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.5718 |
| logD: | -0.3179 |
| logSw: | -3.5411 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.0674 |
| InChI Key: | MHDCJEDWTMUIOF-UHFFFAOYSA-N |