7-{4-[(3,4-dimethylphenoxy)acetyl]piperazin-1-yl}-2-(4-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-{4-[(3,4-dimethylphenoxy)acetyl]piperazin-1-yl}-2-(4-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-{4-[(3,4-dimethylphenoxy)acetyl]piperazin-1-yl}-2-(4-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | F529-0247 |
| Compound Name: | 7-{4-[(3,4-dimethylphenoxy)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: | Cc1ccc(cc1)C1=NN2C(=NC(=CC2=O)N2CCN(CC2)C(COc2ccc(C)c(C)c2)=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.953 |
| logD: | 3.9221 |
| logSw: | -3.9848 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.796 |
| InChI Key: | MSSABBLXKVXXGF-UHFFFAOYSA-N |