N-[4-(2-hydroxyethyl)phenyl]-3-{3-[(4-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide
Chemical Structure Depiction of
N-[4-(2-hydroxyethyl)phenyl]-3-{3-[(4-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide
N-[4-(2-hydroxyethyl)phenyl]-3-{3-[(4-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide
Compound characteristics
| Compound ID: | J077-0939 |
| Compound Name: | N-[4-(2-hydroxyethyl)phenyl]-3-{3-[(4-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide |
| Molecular Weight: | 443.55 |
| Molecular Formula: | C27 H29 N3 O3 |
| Smiles: | Cc1ccc(CN2CCCN(C2=O)c2cccc(c2)C(Nc2ccc(CCO)cc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8455 |
| logD: | 3.8455 |
| logSw: | -3.9306 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.544 |
| InChI Key: | RBHXWHMDRXZJGL-UHFFFAOYSA-N |