3-(2-chlorophenyl)-N-(5-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-5-methyl-1,2-oxazole-4-carboxamide
Chemical Structure Depiction of
3-(2-chlorophenyl)-N-(5-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-5-methyl-1,2-oxazole-4-carboxamide
3-(2-chlorophenyl)-N-(5-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-5-methyl-1,2-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | G856-2475 |
| Compound Name: | 3-(2-chlorophenyl)-N-(5-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-5-methyl-1,2-oxazole-4-carboxamide |
| Molecular Weight: | 492.02 |
| Molecular Formula: | C21 H22 Cl N5 O3 S2 |
| Smiles: | Cc1c(C(Nc2nnc(SCC(NC3CCCCC3)=O)s2)=O)c(c2ccccc2[Cl])no1 |
| Stereo: | ACHIRAL |
| logP: | 4.6149 |
| logD: | 4.5527 |
| logSw: | -4.8835 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.121 |
| InChI Key: | HOCYDGIYBPKRLU-UHFFFAOYSA-N |