2-methyl-N-(4-methylphenyl)-6-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]pyrimidin-4-amine
Chemical Structure Depiction of
2-methyl-N-(4-methylphenyl)-6-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]pyrimidin-4-amine
2-methyl-N-(4-methylphenyl)-6-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]pyrimidin-4-amine
Compound characteristics
| Compound ID: | D430-1168 |
| Compound Name: | 2-methyl-N-(4-methylphenyl)-6-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]pyrimidin-4-amine |
| Molecular Weight: | 468.53 |
| Molecular Formula: | C22 H24 N6 O4 S |
| Smiles: | Cc1ccc(cc1)Nc1cc(nc(C)n1)N1CCN(CC1)S(c1cccc(c1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5595 |
| logD: | 3.6918 |
| logSw: | -4.3603 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.718 |
| InChI Key: | RXPMBXDEFNOVMZ-UHFFFAOYSA-N |