(azepan-1-yl)(1-{3-methyl-5-[2-(2,4,6-trimethylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidin-3-yl)methanone
Chemical Structure Depiction of
(azepan-1-yl)(1-{3-methyl-5-[2-(2,4,6-trimethylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidin-3-yl)methanone
(azepan-1-yl)(1-{3-methyl-5-[2-(2,4,6-trimethylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidin-3-yl)methanone
Compound characteristics
| Compound ID: | F061-1759 |
| Compound Name: | (azepan-1-yl)(1-{3-methyl-5-[2-(2,4,6-trimethylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidin-3-yl)methanone |
| Molecular Weight: | 499.67 |
| Molecular Formula: | C27 H37 N3 O4 S |
| Smiles: | Cc1cc(C)c(/C=C/c2c(c(C)no2)S(N2CCCC(C2)C(N2CCCCCC2)=O)(=O)=O)c(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7466 |
| logD: | 4.7466 |
| logSw: | -4.4357 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.378 |
| InChI Key: | TTYYATHORYVRCT-QHCPKHFHSA-N |