N-(4-{[2-methyl-6-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)-2-nitrobenzamide
Chemical Structure Depiction of
N-(4-{[2-methyl-6-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)-2-nitrobenzamide
N-(4-{[2-methyl-6-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)-2-nitrobenzamide
Compound characteristics
Compound ID: | D430-0463 |
Compound Name: | N-(4-{[2-methyl-6-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)-2-nitrobenzamide |
Molecular Weight: | 434.45 |
Molecular Formula: | C22 H22 N6 O4 |
Smiles: | Cc1nc(cc(n1)N1CCOCC1)Nc1ccc(cc1)NC(c1ccccc1[N+]([O-])=O)=O |
Stereo: | ACHIRAL |
logP: | 3.5741 |
logD: | 3.0223 |
logSw: | -3.9268 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 94.898 |
InChI Key: | JNYDBCPQRPHOKG-UHFFFAOYSA-N |