N-(3-{[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methoxy}phenyl)-3-phenylpropanamide
Chemical Structure Depiction of
N-(3-{[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methoxy}phenyl)-3-phenylpropanamide
N-(3-{[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methoxy}phenyl)-3-phenylpropanamide
Compound characteristics
| Compound ID: | C679-4229 |
| Compound Name: | N-(3-{[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methoxy}phenyl)-3-phenylpropanamide |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C24 H24 N4 O3 S |
| Smiles: | CC(C)C1=NN2C(=NC(COc3cccc(c3)NC(CCc3ccccc3)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.386 |
| logD: | 4.3777 |
| logSw: | -4.416 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.648 |
| InChI Key: | PXNWJVYRSDJEEL-UHFFFAOYSA-N |