N-(4-{[6-(cyclohexylamino)-2-methylpyrimidin-4-yl]amino}phenyl)-3,4-dimethoxybenzene-1-sulfonamide
Chemical Structure Depiction of
N-(4-{[6-(cyclohexylamino)-2-methylpyrimidin-4-yl]amino}phenyl)-3,4-dimethoxybenzene-1-sulfonamide
N-(4-{[6-(cyclohexylamino)-2-methylpyrimidin-4-yl]amino}phenyl)-3,4-dimethoxybenzene-1-sulfonamide
Compound characteristics
| Compound ID: | D640-0064 |
| Compound Name: | N-(4-{[6-(cyclohexylamino)-2-methylpyrimidin-4-yl]amino}phenyl)-3,4-dimethoxybenzene-1-sulfonamide |
| Molecular Weight: | 497.62 |
| Molecular Formula: | C25 H31 N5 O4 S |
| Smiles: | Cc1nc(cc(Nc2ccc(cc2)NS(c2ccc(c(c2)OC)OC)(=O)=O)n1)NC1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.7902 |
| logD: | 4.5871 |
| logSw: | -4.6442 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 94.339 |
| InChI Key: | ZHHGPAVGJDJPOD-UHFFFAOYSA-N |