N-(5-{[(2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
Chemical Structure Depiction of
N-(5-{[(2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
N-(5-{[(2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | G072-2342 |
| Compound Name: | N-(5-{[(2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide |
| Molecular Weight: | 422.55 |
| Molecular Formula: | C16 H18 N6 O2 S3 |
| Smiles: | CC(Nc1nnc(SCC2=CC(N3C(=N2)SC(C2CCCCC2)=N3)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6007 |
| logD: | 3.5999 |
| logSw: | -3.7596 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.359 |
| InChI Key: | FHAQWUSUZDXOSN-UHFFFAOYSA-N |