2-[4-(benzenesulfonyl)piperazin-1-yl]-4-(2H-1,3-benzodioxol-5-yl)pyrimidine
Chemical Structure Depiction of
2-[4-(benzenesulfonyl)piperazin-1-yl]-4-(2H-1,3-benzodioxol-5-yl)pyrimidine
2-[4-(benzenesulfonyl)piperazin-1-yl]-4-(2H-1,3-benzodioxol-5-yl)pyrimidine
Compound characteristics
| Compound ID: | V020-5833 |
| Compound Name: | 2-[4-(benzenesulfonyl)piperazin-1-yl]-4-(2H-1,3-benzodioxol-5-yl)pyrimidine |
| Molecular Weight: | 424.48 |
| Molecular Formula: | C21 H20 N4 O4 S |
| Salt: | not_available |
| Smiles: | C1CN(CCN1c1nccc(c2ccc3c(c2)OCO3)n1)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.69 |
| logD: | 3.6879 |
| logSw: | -4.1335 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.984 |
| InChI Key: | IZZYLPVOAYONHT-UHFFFAOYSA-N |