7-[4-(3-fluoro-4-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-fluoro-4-methylbenzoyl)piperazin-1-yl]-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-[4-(3-fluoro-4-methylbenzoyl)piperazin-1-yl]-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | F529-0145 |
| Compound Name: | 7-[4-(3-fluoro-4-methylbenzoyl)piperazin-1-yl]-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 463.53 |
| Molecular Formula: | C24 H22 F N5 O2 S |
| Smiles: | Cc1ccccc1C1=NN2C(=NC(=CC2=O)N2CCN(CC2)C(c2ccc(C)c(c2)F)=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.5308 |
| logD: | 3.5267 |
| logSw: | -3.6751 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.825 |
| InChI Key: | HOTAOEHAVOCMLN-UHFFFAOYSA-N |