2-(3-methylpiperidin-1-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}-7-oxo-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide
Chemical Structure Depiction of
2-(3-methylpiperidin-1-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}-7-oxo-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide
2-(3-methylpiperidin-1-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}-7-oxo-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | F149-0790 |
| Compound Name: | 2-(3-methylpiperidin-1-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}-7-oxo-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide |
| Molecular Weight: | 429.56 |
| Molecular Formula: | C20 H23 N5 O2 S2 |
| Smiles: | CC1CCCN(C1)C1=NN2C(=CC(N=C2S1)=O)C(NCc1ccc(cc1)SC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2064 |
| logD: | 2.8549 |
| logSw: | -3.6089 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.36 |
| InChI Key: | KXRDEEBDGSDJKH-ZDUSSCGKSA-N |