2-(2-chlorophenoxy)-N-(3-{[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methoxy}phenyl)acetamide
Chemical Structure Depiction of
2-(2-chlorophenoxy)-N-(3-{[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methoxy}phenyl)acetamide
2-(2-chlorophenoxy)-N-(3-{[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methoxy}phenyl)acetamide
Compound characteristics
| Compound ID: | C679-4206 |
| Compound Name: | 2-(2-chlorophenoxy)-N-(3-{[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methoxy}phenyl)acetamide |
| Molecular Weight: | 484.96 |
| Molecular Formula: | C23 H21 Cl N4 O4 S |
| Smiles: | CC(C)C1=NN2C(=NC(COc3cccc(c3)NC(COc3ccccc3[Cl])=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.4389 |
| logD: | 4.4306 |
| logSw: | -4.4661 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.233 |
| InChI Key: | POMUBAQVVADUGB-UHFFFAOYSA-N |