2-(3-methylthiophen-2-yl)-1-[4-(propan-2-yl)benzene-1-sulfonyl]azepane
Chemical Structure Depiction of
2-(3-methylthiophen-2-yl)-1-[4-(propan-2-yl)benzene-1-sulfonyl]azepane
2-(3-methylthiophen-2-yl)-1-[4-(propan-2-yl)benzene-1-sulfonyl]azepane
Compound characteristics
| Compound ID: | J005-0656 |
| Compound Name: | 2-(3-methylthiophen-2-yl)-1-[4-(propan-2-yl)benzene-1-sulfonyl]azepane |
| Molecular Weight: | 377.57 |
| Molecular Formula: | C20 H27 N O2 S2 |
| Smiles: | CC(C)c1ccc(cc1)S(N1CCCCCC1c1c(C)ccs1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9306 |
| logD: | 5.9306 |
| logSw: | -5.4369 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.498 |
| InChI Key: | CMYOTPWEESKVHJ-IBGZPJMESA-N |