7-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | F526-0047 |
| Compound Name: | 7-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 485.56 |
| Molecular Formula: | C22 H20 F N5 O3 S2 |
| Smiles: | Cc1cccc(c1)C1=NN2C(=NC(=CC2=O)N2CCN(CC2)S(c2ccc(cc2)F)(=O)=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.3578 |
| logD: | 3.349 |
| logSw: | -3.6683 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.887 |
| InChI Key: | KBSNZKQBACAOEL-UHFFFAOYSA-N |