N-(3-{[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methoxy}phenyl)-3-phenylprop-2-enamide
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-phenylprop-2-enamide
N-(3-{[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methoxy}phenyl)-3-phenylprop-2-enamide
Compound characteristics
| Compound ID: | C679-4225 |
| Compound Name: | N-(3-{[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methoxy}phenyl)-3-phenylprop-2-enamide |
| Molecular Weight: | 446.53 |
| Molecular Formula: | C24 H22 N4 O3 S |
| Smiles: | CC(C)C1=NN2C(=NC(COc3cccc(c3)NC(/C=C/c3ccccc3)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.6915 |
| logD: | 4.6832 |
| logSw: | -4.4524 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.648 |
| InChI Key: | PZAWELAMVFQZAI-UHFFFAOYSA-N |