4-(2H-1,3-benzodioxol-5-yl)-2-[4-(2-methoxy-4-methylbenzene-1-sulfonyl)piperazin-1-yl]pyrimidine
Chemical Structure Depiction of
4-(2H-1,3-benzodioxol-5-yl)-2-[4-(2-methoxy-4-methylbenzene-1-sulfonyl)piperazin-1-yl]pyrimidine
4-(2H-1,3-benzodioxol-5-yl)-2-[4-(2-methoxy-4-methylbenzene-1-sulfonyl)piperazin-1-yl]pyrimidine
Compound characteristics
| Compound ID: | V017-9082 |
| Compound Name: | 4-(2H-1,3-benzodioxol-5-yl)-2-[4-(2-methoxy-4-methylbenzene-1-sulfonyl)piperazin-1-yl]pyrimidine |
| Molecular Weight: | 468.53 |
| Molecular Formula: | C23 H24 N4 O5 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(c(c1)OC)S(N1CCN(CC1)c1nccc(c2ccc3c(c2)OCO3)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2001 |
| logD: | 4.198 |
| logSw: | -4.3031 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 77.614 |
| InChI Key: | JUIFJFHSUVPWRE-UHFFFAOYSA-N |