N-[(1,5-dihydro-3H-2,4-benzodioxepin-3-yl)methyl]-4-methylaniline
Chemical Structure Depiction of
N-[(1,5-dihydro-3H-2,4-benzodioxepin-3-yl)methyl]-4-methylaniline
N-[(1,5-dihydro-3H-2,4-benzodioxepin-3-yl)methyl]-4-methylaniline
Compound characteristics
| Compound ID: | 8010-2839 |
| Compound Name: | N-[(1,5-dihydro-3H-2,4-benzodioxepin-3-yl)methyl]-4-methylaniline |
| Molecular Weight: | 269.34 |
| Molecular Formula: | C17 H19 N O2 |
| Smiles: | Cc1ccc(cc1)NCC1OCc2ccccc2CO1 |
| Stereo: | ACHIRAL |
| logP: | 3.6978 |
| logD: | 3.6977 |
| logSw: | -3.7989 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.7009 |
| InChI Key: | UYMZOENZYSVDIR-UHFFFAOYSA-N |