(azepan-1-yl)[6-(4-methylpiperidine-1-sulfonyl)-2,3-dihydro-1,4-benzodioxin-2-yl]methanone
Chemical Structure Depiction of
(azepan-1-yl)[6-(4-methylpiperidine-1-sulfonyl)-2,3-dihydro-1,4-benzodioxin-2-yl]methanone
(azepan-1-yl)[6-(4-methylpiperidine-1-sulfonyl)-2,3-dihydro-1,4-benzodioxin-2-yl]methanone
Compound characteristics
| Compound ID: | G240-1686 |
| Compound Name: | (azepan-1-yl)[6-(4-methylpiperidine-1-sulfonyl)-2,3-dihydro-1,4-benzodioxin-2-yl]methanone |
| Molecular Weight: | 422.54 |
| Molecular Formula: | C21 H30 N2 O5 S |
| Smiles: | CC1CCN(CC1)S(c1ccc2c(c1)OCC(C(N1CCCCCC1)=O)O2)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0908 |
| logD: | 3.0908 |
| logSw: | -3.4009 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.366 |
| InChI Key: | KHAJDPSLHJPMQE-HXUWFJFHSA-N |