N-(4-{[2-methyl-6-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)-4-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-(4-{[2-methyl-6-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)-4-nitrobenzene-1-sulfonamide
N-(4-{[2-methyl-6-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)-4-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | D430-1294 |
| Compound Name: | N-(4-{[2-methyl-6-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)-4-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 470.51 |
| Molecular Formula: | C21 H22 N6 O5 S |
| Smiles: | Cc1nc(cc(n1)N1CCOCC1)Nc1ccc(cc1)NS(c1ccc(cc1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7562 |
| logD: | 3.2044 |
| logSw: | -3.9617 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 112.758 |
| InChI Key: | VBQJJFSPANWYPW-UHFFFAOYSA-N |