2,5-diethoxy-N-(4-{[4-(4-methoxyanilino)-6-methylpyrimidin-2-yl]amino}phenyl)benzene-1-sulfonamide
Chemical Structure Depiction of
2,5-diethoxy-N-(4-{[4-(4-methoxyanilino)-6-methylpyrimidin-2-yl]amino}phenyl)benzene-1-sulfonamide
2,5-diethoxy-N-(4-{[4-(4-methoxyanilino)-6-methylpyrimidin-2-yl]amino}phenyl)benzene-1-sulfonamide
Compound characteristics
Compound ID: | G869-1161 |
Compound Name: | 2,5-diethoxy-N-(4-{[4-(4-methoxyanilino)-6-methylpyrimidin-2-yl]amino}phenyl)benzene-1-sulfonamide |
Molecular Weight: | 549.65 |
Molecular Formula: | C28 H31 N5 O5 S |
Smiles: | CCOc1ccc(c(c1)S(Nc1ccc(cc1)Nc1nc(C)cc(Nc2ccc(cc2)OC)n1)(=O)=O)OCC |
Stereo: | ACHIRAL |
logP: | 6.0728 |
logD: | 5.223 |
logSw: | -5.5778 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 100.67 |
InChI Key: | JBNRNGGYKIPROI-UHFFFAOYSA-N |