5-{[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]sulfanyl}-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]sulfanyl}-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
5-{[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]sulfanyl}-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | F736-1621 |
Compound Name: | 5-{[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]sulfanyl}-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 459.63 |
Molecular Formula: | C22 H29 N5 O2 S2 |
Smiles: | Cc1ccccc1NC(c1nnc(SCC(N2CCN(CC2)C2CCCCC2)=O)s1)=O |
Stereo: | ACHIRAL |
logP: | 3.3862 |
logD: | 3.277 |
logSw: | -3.642 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 64.711 |
InChI Key: | GXOUELAUDCFHPR-UHFFFAOYSA-N |