2-(4-methylpiperidin-1-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
2-(4-methylpiperidin-1-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
2-(4-methylpiperidin-1-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | G205-0471 |
| Compound Name: | 2-(4-methylpiperidin-1-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 443.59 |
| Molecular Formula: | C21 H25 N5 O2 S2 |
| Smiles: | CC1CCN(CC1)C1=NN2C(=NC=C(C(NCCc3ccc(cc3)SC)=O)C2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.0441 |
| logD: | 3.038 |
| logSw: | -3.4555 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.081 |
| InChI Key: | UVTITEDKSABLBU-UHFFFAOYSA-N |