N-(2-{3-[(2,5-dimethylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}-5-methylphenyl)-3-methylbenzamide
Chemical Structure Depiction of
N-(2-{3-[(2,5-dimethylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}-5-methylphenyl)-3-methylbenzamide
N-(2-{3-[(2,5-dimethylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}-5-methylphenyl)-3-methylbenzamide
Compound characteristics
| Compound ID: | V005-1050 |
| Compound Name: | N-(2-{3-[(2,5-dimethylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}-5-methylphenyl)-3-methylbenzamide |
| Molecular Weight: | 441.57 |
| Molecular Formula: | C28 H31 N3 O2 |
| Smiles: | Cc1cccc(c1)C(Nc1cc(C)ccc1N1CCCN(Cc2cc(C)ccc2C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3423 |
| logD: | 6.3314 |
| logSw: | -5.4449 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.889 |
| InChI Key: | CFDWTAOEPPDFFO-UHFFFAOYSA-N |