4-methyl-N-(5-methyl-2-{3-[(2-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-3-nitrobenzamide
Chemical Structure Depiction of
4-methyl-N-(5-methyl-2-{3-[(2-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-3-nitrobenzamide
4-methyl-N-(5-methyl-2-{3-[(2-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | V025-1471 |
| Compound Name: | 4-methyl-N-(5-methyl-2-{3-[(2-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-3-nitrobenzamide |
| Molecular Weight: | 472.54 |
| Molecular Formula: | C27 H28 N4 O4 |
| Smiles: | Cc1ccc(c(c1)NC(c1ccc(C)c(c1)[N+]([O-])=O)=O)N1CCCN(Cc2ccccc2C)C1=O |
| Stereo: | ACHIRAL |
| logP: | 5.892 |
| logD: | 5.8399 |
| logSw: | -5.4231 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.97 |
| InChI Key: | WULZRBOQFUCGLO-UHFFFAOYSA-N |