N-(4-{[2-methyl-6-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)-3-nitrobenzamide
Chemical Structure Depiction of
N-(4-{[2-methyl-6-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)-3-nitrobenzamide
N-(4-{[2-methyl-6-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | D430-0464 |
| Compound Name: | N-(4-{[2-methyl-6-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)-3-nitrobenzamide |
| Molecular Weight: | 434.45 |
| Molecular Formula: | C22 H22 N6 O4 |
| Smiles: | Cc1nc(cc(n1)N1CCOCC1)Nc1ccc(cc1)NC(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8312 |
| logD: | 3.2794 |
| logSw: | -3.9608 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.199 |
| InChI Key: | OAVUYMSXBTXLQY-UHFFFAOYSA-N |