7-{4-[(2,3-dimethylphenoxy)acetyl]piperazin-1-yl}-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-{4-[(2,3-dimethylphenoxy)acetyl]piperazin-1-yl}-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-{4-[(2,3-dimethylphenoxy)acetyl]piperazin-1-yl}-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | F529-0032 |
| Compound Name: | 7-{4-[(2,3-dimethylphenoxy)acetyl]piperazin-1-yl}-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 475.57 |
| Molecular Formula: | C25 H25 N5 O3 S |
| Smiles: | Cc1cccc(c1C)OCC(N1CCN(CC1)C1=CC(N2C(=N1)SC(c1ccccc1)=N2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2661 |
| logD: | 3.2586 |
| logSw: | -3.3269 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.883 |
| InChI Key: | XGXFCLZNCOHDFX-UHFFFAOYSA-N |