2-{[(2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-N-(naphthalen-1-yl)acetamide
Chemical Structure Depiction of
2-{[(2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-N-(naphthalen-1-yl)acetamide
2-{[(2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-N-(naphthalen-1-yl)acetamide
Compound characteristics
| Compound ID: | G432-0169 |
| Compound Name: | 2-{[(2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-N-(naphthalen-1-yl)acetamide |
| Molecular Weight: | 422.53 |
| Molecular Formula: | C21 H18 N4 O2 S2 |
| Smiles: | C1CC1C1=NN2C(=NC(CSCC(Nc3cccc4ccccc34)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.7611 |
| logD: | 3.7578 |
| logSw: | -4.1174 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.702 |
| InChI Key: | XQSXZECAMPMDMK-UHFFFAOYSA-N |