7-[4-(3-methylbenzoyl)piperazin-1-yl]-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-[4-(3-methylbenzoyl)piperazin-1-yl]-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-[4-(3-methylbenzoyl)piperazin-1-yl]-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | F529-0101 |
| Compound Name: | 7-[4-(3-methylbenzoyl)piperazin-1-yl]-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C24 H23 N5 O2 S |
| Smiles: | Cc1cccc(c1)C(N1CCN(CC1)C1=CC(N2C(=N1)SC(c1ccccc1C)=N2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2324 |
| logD: | 3.2283 |
| logSw: | -3.4256 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.825 |
| InChI Key: | MURSDTOHRJGUJF-UHFFFAOYSA-N |