N-{[4-(azepan-1-yl)phenyl]methyl}-N-methylbut-2-ynamide
Chemical Structure Depiction of
N-{[4-(azepan-1-yl)phenyl]methyl}-N-methylbut-2-ynamide
N-{[4-(azepan-1-yl)phenyl]methyl}-N-methylbut-2-ynamide
Compound characteristics
| Compound ID: | T001-1704 |
| Compound Name: | N-{[4-(azepan-1-yl)phenyl]methyl}-N-methylbut-2-ynamide |
| Molecular Weight: | 284.4 |
| Molecular Formula: | C18 H24 N2 O |
| Smiles: | CC#CC(N(C)Cc1ccc(cc1)N1CCCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7422 |
| logD: | 3.5019 |
| logSw: | -3.7452 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 19.9165 |
| InChI Key: | FOPISGLJEPEZPY-UHFFFAOYSA-N |