7-[4-(2,5-dimethylbenzene-1-sulfonyl)piperazin-1-yl]-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-[4-(2,5-dimethylbenzene-1-sulfonyl)piperazin-1-yl]-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-[4-(2,5-dimethylbenzene-1-sulfonyl)piperazin-1-yl]-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | F526-0021 |
| Compound Name: | 7-[4-(2,5-dimethylbenzene-1-sulfonyl)piperazin-1-yl]-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 481.59 |
| Molecular Formula: | C23 H23 N5 O3 S2 |
| Smiles: | Cc1ccc(C)c(c1)S(N1CCN(CC1)C1=CC(N2C(=N1)SC(c1ccccc1)=N2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6385 |
| logD: | 3.631 |
| logSw: | -3.7808 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.887 |
| InChI Key: | XQRRDBKJGHPQRQ-UHFFFAOYSA-N |