2-phenyl-7-[4-(2,4,5-trimethylbenzene-1-sulfonyl)piperazin-1-yl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-phenyl-7-[4-(2,4,5-trimethylbenzene-1-sulfonyl)piperazin-1-yl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-phenyl-7-[4-(2,4,5-trimethylbenzene-1-sulfonyl)piperazin-1-yl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | F526-0005 |
| Compound Name: | 2-phenyl-7-[4-(2,4,5-trimethylbenzene-1-sulfonyl)piperazin-1-yl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 495.62 |
| Molecular Formula: | C24 H25 N5 O3 S2 |
| Smiles: | Cc1cc(C)c(cc1C)S(N1CCN(CC1)C1=CC(N2C(=N1)SC(c1ccccc1)=N2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2108 |
| logD: | 4.2033 |
| logSw: | -4.2161 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.887 |
| InChI Key: | WQHPBLLRFBAIGI-UHFFFAOYSA-N |