2-methyl-4-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]-6-(piperidin-1-yl)pyrimidine
Chemical Structure Depiction of
2-methyl-4-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]-6-(piperidin-1-yl)pyrimidine
2-methyl-4-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]-6-(piperidin-1-yl)pyrimidine
Compound characteristics
| Compound ID: | D430-1103 |
| Compound Name: | 2-methyl-4-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]-6-(piperidin-1-yl)pyrimidine |
| Molecular Weight: | 446.53 |
| Molecular Formula: | C20 H26 N6 O4 S |
| Smiles: | Cc1nc(cc(n1)N1CCN(CC1)S(c1cccc(c1)[N+]([O-])=O)(=O)=O)N1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 3.9379 |
| logD: | 3.8749 |
| logSw: | -3.9061 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 89.155 |
| InChI Key: | WHRLTQWKDKJUJX-UHFFFAOYSA-N |