(azepan-1-yl)(1-{3-methyl-5-[2-(3-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidin-4-yl)methanone
Chemical Structure Depiction of
(azepan-1-yl)(1-{3-methyl-5-[2-(3-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidin-4-yl)methanone
(azepan-1-yl)(1-{3-methyl-5-[2-(3-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidin-4-yl)methanone
Compound characteristics
| Compound ID: | K906-3777 |
| Compound Name: | (azepan-1-yl)(1-{3-methyl-5-[2-(3-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidin-4-yl)methanone |
| Molecular Weight: | 471.62 |
| Molecular Formula: | C25 H33 N3 O4 S |
| Smiles: | Cc1cccc(/C=C/c2c(c(C)no2)S(N2CCC(CC2)C(N2CCCCCC2)=O)(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.2276 |
| logD: | 4.2276 |
| logSw: | -4.2135 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.444 |
| InChI Key: | HOUMBXXWEDRLCV-ZHACJKMWSA-N |