N-{5-[4-(2-methylphenyl)piperazine-1-sulfonyl]-1,3,4-thiadiazol-2-yl}benzamide
Chemical Structure Depiction of
N-{5-[4-(2-methylphenyl)piperazine-1-sulfonyl]-1,3,4-thiadiazol-2-yl}benzamide
N-{5-[4-(2-methylphenyl)piperazine-1-sulfonyl]-1,3,4-thiadiazol-2-yl}benzamide
Compound characteristics
Compound ID: | E157-1826 |
Compound Name: | N-{5-[4-(2-methylphenyl)piperazine-1-sulfonyl]-1,3,4-thiadiazol-2-yl}benzamide |
Molecular Weight: | 443.55 |
Molecular Formula: | C20 H21 N5 O3 S2 |
Smiles: | Cc1ccccc1N1CCN(CC1)S(c1nnc(NC(c2ccccc2)=O)s1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.9321 |
logD: | 2.319 |
logSw: | -3.9384 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 81.32 |
InChI Key: | XTMOVKWCUKALBY-UHFFFAOYSA-N |