7-[4-(benzenesulfonyl)piperazin-1-yl]-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-[4-(benzenesulfonyl)piperazin-1-yl]-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-[4-(benzenesulfonyl)piperazin-1-yl]-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | F526-0044 |
| Compound Name: | 7-[4-(benzenesulfonyl)piperazin-1-yl]-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 467.57 |
| Molecular Formula: | C22 H21 N5 O3 S2 |
| Smiles: | Cc1ccccc1C1=NN2C(=NC(=CC2=O)N2CCN(CC2)S(c2ccccc2)(=O)=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.0318 |
| logD: | 3.0277 |
| logSw: | -3.5023 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.887 |
| InChI Key: | YMDXQRJITOTAEQ-UHFFFAOYSA-N |