4-chloro-N-(2-{3-[(3,5-dimethylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)benzamide
Chemical Structure Depiction of
4-chloro-N-(2-{3-[(3,5-dimethylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)benzamide
4-chloro-N-(2-{3-[(3,5-dimethylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)benzamide
Compound characteristics
| Compound ID: | V021-1313 |
| Compound Name: | 4-chloro-N-(2-{3-[(3,5-dimethylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)benzamide |
| Molecular Weight: | 447.96 |
| Molecular Formula: | C26 H26 Cl N3 O2 |
| Smiles: | Cc1cc(C)cc(CN2CCCN(C2=O)c2ccccc2NC(c2ccc(cc2)[Cl])=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.1771 |
| logD: | 6.1368 |
| logSw: | -6.0558 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.889 |
| InChI Key: | JKPWICDWMUOECR-UHFFFAOYSA-N |