2-(3-methylpiperidin-1-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
2-(3-methylpiperidin-1-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
2-(3-methylpiperidin-1-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | G205-2466 |
| Compound Name: | 2-(3-methylpiperidin-1-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 429.56 |
| Molecular Formula: | C20 H23 N5 O2 S2 |
| Smiles: | CC1CCCN(C1)C1=NN2C(=NC=C(C(NCc3ccc(cc3)SC)=O)C2=O)S1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0191 |
| logD: | 2.8963 |
| logSw: | -3.4068 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.173 |
| InChI Key: | QTUCJVDTTWFJEH-ZDUSSCGKSA-N |