N-(4-{3-[(3-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-2-methoxyacetamide
Chemical Structure Depiction of
N-(4-{3-[(3-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-2-methoxyacetamide
N-(4-{3-[(3-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-2-methoxyacetamide
Compound characteristics
| Compound ID: | V028-8320 |
| Compound Name: | N-(4-{3-[(3-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-2-methoxyacetamide |
| Molecular Weight: | 378.43 |
| Molecular Formula: | C21 H22 N4 O3 |
| Smiles: | COCC(Nc1ccc(cc1)N1CCCN(Cc2cccc(C#N)c2)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1521 |
| logD: | 2.1521 |
| logSw: | -2.9951 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.426 |
| InChI Key: | QKRPUFZMLZXQKX-UHFFFAOYSA-N |