N-cyclohexyl-4-[4-(1,2-dihydroacenaphthylene-3-sulfonyl)piperazin-1-yl]-6-methylpyrimidin-2-amine
Chemical Structure Depiction of
N-cyclohexyl-4-[4-(1,2-dihydroacenaphthylene-3-sulfonyl)piperazin-1-yl]-6-methylpyrimidin-2-amine
N-cyclohexyl-4-[4-(1,2-dihydroacenaphthylene-3-sulfonyl)piperazin-1-yl]-6-methylpyrimidin-2-amine
Compound characteristics
| Compound ID: | D637-0054 |
| Compound Name: | N-cyclohexyl-4-[4-(1,2-dihydroacenaphthylene-3-sulfonyl)piperazin-1-yl]-6-methylpyrimidin-2-amine |
| Molecular Weight: | 491.66 |
| Molecular Formula: | C27 H33 N5 O2 S |
| Smiles: | Cc1cc(nc(NC2CCCCC2)n1)N1CCN(CC1)S(c1ccc2cccc3CCc1c23)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2847 |
| logD: | 6.2771 |
| logSw: | -6.5449 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.16 |
| InChI Key: | ZYMSMKBNAQGSCW-UHFFFAOYSA-N |