N-[2-(cyclohex-1-en-1-yl)ethyl]-2-(methanesulfonyl)-4-(4-methylbenzene-1-sulfonyl)-1,3-thiazol-5-amine
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-(methanesulfonyl)-4-(4-methylbenzene-1-sulfonyl)-1,3-thiazol-5-amine
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-(methanesulfonyl)-4-(4-methylbenzene-1-sulfonyl)-1,3-thiazol-5-amine
Compound characteristics
Compound ID: | D206-1053 |
Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-2-(methanesulfonyl)-4-(4-methylbenzene-1-sulfonyl)-1,3-thiazol-5-amine |
Molecular Weight: | 440.6 |
Molecular Formula: | C19 H24 N2 O4 S3 |
Smiles: | Cc1ccc(cc1)S(c1c(NCCC2CCCCC=2)sc(n1)S(C)(=O)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.7701 |
logD: | 3.7701 |
logSw: | -3.7869 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 78.858 |
InChI Key: | WQMANAOZOROSOY-UHFFFAOYSA-N |