N-[(1,5-dihydro-3H-2,4-benzodioxepin-3-yl)methyl]hexan-1-amine
Chemical Structure Depiction of
N-[(1,5-dihydro-3H-2,4-benzodioxepin-3-yl)methyl]hexan-1-amine
N-[(1,5-dihydro-3H-2,4-benzodioxepin-3-yl)methyl]hexan-1-amine
Compound characteristics
| Compound ID: | 6131-0325 |
| Compound Name: | N-[(1,5-dihydro-3H-2,4-benzodioxepin-3-yl)methyl]hexan-1-amine |
| Molecular Weight: | 263.38 |
| Molecular Formula: | C16 H25 N O2 |
| Smiles: | CCCCCCNCC1OCc2ccccc2CO1 |
| Stereo: | ACHIRAL |
| logP: | 3.2422 |
| logD: | 2.1497 |
| logSw: | -3.1221 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.3452 |
| InChI Key: | APULWHREKIZIPB-UHFFFAOYSA-N |