N-(4-{3-[(3-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-4-methoxybenzamide
Chemical Structure Depiction of
N-(4-{3-[(3-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-4-methoxybenzamide
N-(4-{3-[(3-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-4-methoxybenzamide
Compound characteristics
| Compound ID: | V028-5648 |
| Compound Name: | N-(4-{3-[(3-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-4-methoxybenzamide |
| Molecular Weight: | 440.5 |
| Molecular Formula: | C26 H24 N4 O3 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)C(Nc1ccc(cc1)N1CCCN(Cc2cccc(C#N)c2)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8049 |
| logD: | 3.8048 |
| logSw: | -4.0758 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.488 |
| InChI Key: | AMRKTCQRMBQGHR-UHFFFAOYSA-N |