4-chloro-N-(2-{3-[(3,5-dimethoxyphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)benzamide
Chemical Structure Depiction of
4-chloro-N-(2-{3-[(3,5-dimethoxyphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)benzamide
4-chloro-N-(2-{3-[(3,5-dimethoxyphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)benzamide
Compound characteristics
| Compound ID: | V020-0094 |
| Compound Name: | 4-chloro-N-(2-{3-[(3,5-dimethoxyphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)benzamide |
| Molecular Weight: | 479.96 |
| Molecular Formula: | C26 H26 Cl N3 O4 |
| Smiles: | COc1cc(CN2CCCN(C2=O)c2ccccc2NC(c2ccc(cc2)[Cl])=O)cc(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 5.0278 |
| logD: | 4.9874 |
| logSw: | -5.1758 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.977 |
| InChI Key: | VTJYVRSUXBEKOG-UHFFFAOYSA-N |