N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-({[2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-({[2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}sulfanyl)acetamide
N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-({[2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | G432-0091 |
| Compound Name: | N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-({[2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}sulfanyl)acetamide |
| Molecular Weight: | 452.62 |
| Molecular Formula: | C18 H24 N6 O2 S3 |
| Smiles: | CCCCc1nnc(NC(CSCC2=CC(N3C(=N2)SC(CC(C)C)=N3)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.3594 |
| logD: | 4.3082 |
| logSw: | -4.0611 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.364 |
| InChI Key: | BDZUZKDLWOUALJ-UHFFFAOYSA-N |