7-{4-[(2-ethylphenoxy)acetyl]piperazin-1-yl}-2-(4-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-{4-[(2-ethylphenoxy)acetyl]piperazin-1-yl}-2-(4-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-{4-[(2-ethylphenoxy)acetyl]piperazin-1-yl}-2-(4-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | F529-0249 |
| Compound Name: | 7-{4-[(2-ethylphenoxy)acetyl]piperazin-1-yl}-2-(4-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 489.6 |
| Molecular Formula: | C26 H27 N5 O3 S |
| Smiles: | CCc1ccccc1OCC(N1CCN(CC1)C1=CC(N2C(=N1)SC(c1ccc(C)cc1)=N2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8122 |
| logD: | 3.7813 |
| logSw: | -3.9216 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.883 |
| InChI Key: | JDDQHBVNAJOMMI-UHFFFAOYSA-N |