2-{4-[2-(methanesulfonyl)-4-(4-methylbenzene-1-sulfonyl)-1,3-thiazol-5-yl]piperazin-1-yl}ethan-1-ol
Chemical Structure Depiction of
2-{4-[2-(methanesulfonyl)-4-(4-methylbenzene-1-sulfonyl)-1,3-thiazol-5-yl]piperazin-1-yl}ethan-1-ol
2-{4-[2-(methanesulfonyl)-4-(4-methylbenzene-1-sulfonyl)-1,3-thiazol-5-yl]piperazin-1-yl}ethan-1-ol
Compound characteristics
Compound ID: | D206-1023 |
Compound Name: | 2-{4-[2-(methanesulfonyl)-4-(4-methylbenzene-1-sulfonyl)-1,3-thiazol-5-yl]piperazin-1-yl}ethan-1-ol |
Molecular Weight: | 445.58 |
Molecular Formula: | C17 H23 N3 O5 S3 |
Smiles: | Cc1ccc(cc1)S(c1c(N2CCN(CC2)CCO)sc(n1)S(C)(=O)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 1.5582 |
logD: | 1.427 |
logSw: | -2.1966 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 93.763 |
InChI Key: | GJDMMOUHEIZTQC-UHFFFAOYSA-N |