N-(2-acetylphenyl)-4-{3-[(4-chlorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide
Chemical Structure Depiction of
N-(2-acetylphenyl)-4-{3-[(4-chlorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide
N-(2-acetylphenyl)-4-{3-[(4-chlorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide
Compound characteristics
| Compound ID: | J076-0557 |
| Compound Name: | N-(2-acetylphenyl)-4-{3-[(4-chlorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide |
| Molecular Weight: | 461.95 |
| Molecular Formula: | C26 H24 Cl N3 O3 |
| Smiles: | CC(c1ccccc1NC(c1ccc(cc1)N1CCCN(Cc2ccc(cc2)[Cl])C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6353 |
| logD: | 4.5028 |
| logSw: | -4.7941 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.017 |
| InChI Key: | IBFUXIBNQMYPEI-UHFFFAOYSA-N |