(azepan-1-yl)(1-{5-[2-(4-methoxyphenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidin-4-yl)methanone
Chemical Structure Depiction of
(azepan-1-yl)(1-{5-[2-(4-methoxyphenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidin-4-yl)methanone
(azepan-1-yl)(1-{5-[2-(4-methoxyphenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidin-4-yl)methanone
Compound characteristics
| Compound ID: | K906-3778 |
| Compound Name: | (azepan-1-yl)(1-{5-[2-(4-methoxyphenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidin-4-yl)methanone |
| Molecular Weight: | 487.62 |
| Molecular Formula: | C25 H33 N3 O5 S |
| Smiles: | Cc1c(c(/C=C/c2ccc(cc2)OC)on1)S(N1CCC(CC1)C(N1CCCCCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6285 |
| logD: | 3.6285 |
| logSw: | -3.8551 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 77.988 |
| InChI Key: | FKLXAXCNDYORQR-UHFFFAOYSA-N |