N~2~-[4-(4-chlorobenzene-1-sulfonyl)-2-(ethanesulfonyl)-1,3-thiazol-5-yl]-N~1~,N~1~-dimethylethane-1,2-diamine
Chemical Structure Depiction of
N~2~-[4-(4-chlorobenzene-1-sulfonyl)-2-(ethanesulfonyl)-1,3-thiazol-5-yl]-N~1~,N~1~-dimethylethane-1,2-diamine
N~2~-[4-(4-chlorobenzene-1-sulfonyl)-2-(ethanesulfonyl)-1,3-thiazol-5-yl]-N~1~,N~1~-dimethylethane-1,2-diamine
Compound characteristics
Compound ID: | C848-0353 |
Compound Name: | N~2~-[4-(4-chlorobenzene-1-sulfonyl)-2-(ethanesulfonyl)-1,3-thiazol-5-yl]-N~1~,N~1~-dimethylethane-1,2-diamine |
Molecular Weight: | 437.98 |
Molecular Formula: | C15 H20 Cl N3 O4 S3 |
Smiles: | CCS(c1nc(c(NCCN(C)C)s1)S(c1ccc(cc1)[Cl])(=O)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.6238 |
logD: | 0.9508 |
logSw: | -3.4968 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 82.09 |
InChI Key: | LFUVJJSKXGQJFH-UHFFFAOYSA-N |