N-(3-{3-[(2-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-3-methoxybenzamide
Chemical Structure Depiction of
N-(3-{3-[(2-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-3-methoxybenzamide
N-(3-{3-[(2-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-3-methoxybenzamide
Compound characteristics
| Compound ID: | V028-7651 |
| Compound Name: | N-(3-{3-[(2-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-3-methoxybenzamide |
| Molecular Weight: | 440.5 |
| Molecular Formula: | C26 H24 N4 O3 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)C(Nc1cccc(c1)N1CCCN(Cc2ccccc2C#N)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4723 |
| logD: | 4.4722 |
| logSw: | -4.3112 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.488 |
| InChI Key: | JYBFOXAYTAEOLV-UHFFFAOYSA-N |