7-(4-benzoylpiperazin-1-yl)-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-(4-benzoylpiperazin-1-yl)-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-(4-benzoylpiperazin-1-yl)-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | F529-0147 |
| Compound Name: | 7-(4-benzoylpiperazin-1-yl)-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 431.52 |
| Molecular Formula: | C23 H21 N5 O2 S |
| Smiles: | Cc1cccc(c1)C1=NN2C(=NC(=CC2=O)N2CCN(CC2)C(c2ccccc2)=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 2.9522 |
| logD: | 2.9434 |
| logSw: | -3.2357 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.825 |
| InChI Key: | XVVARFMUIUQUEM-UHFFFAOYSA-N |