1-[2-(4-methoxyphenyl)-4-(4-methylbenzene-1-sulfonyl)-1,3-oxazol-5-yl]azepane
Chemical Structure Depiction of
1-[2-(4-methoxyphenyl)-4-(4-methylbenzene-1-sulfonyl)-1,3-oxazol-5-yl]azepane
1-[2-(4-methoxyphenyl)-4-(4-methylbenzene-1-sulfonyl)-1,3-oxazol-5-yl]azepane
Compound characteristics
Compound ID: | 6285-0265 |
Compound Name: | 1-[2-(4-methoxyphenyl)-4-(4-methylbenzene-1-sulfonyl)-1,3-oxazol-5-yl]azepane |
Molecular Weight: | 426.53 |
Molecular Formula: | C23 H26 N2 O4 S |
Smiles: | Cc1ccc(cc1)S(c1c(N2CCCCCC2)oc(c2ccc(cc2)OC)n1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 5.5318 |
logD: | 5.5318 |
logSw: | -5.3386 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 59.354 |
InChI Key: | GXIWANYNVSDXOR-UHFFFAOYSA-N |