N-[4-(2-hydroxyethyl)phenyl]-4-{3-[(3-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide
Chemical Structure Depiction of
N-[4-(2-hydroxyethyl)phenyl]-4-{3-[(3-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide
N-[4-(2-hydroxyethyl)phenyl]-4-{3-[(3-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide
Compound characteristics
| Compound ID: | J076-0306 |
| Compound Name: | N-[4-(2-hydroxyethyl)phenyl]-4-{3-[(3-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide |
| Molecular Weight: | 443.55 |
| Molecular Formula: | C27 H29 N3 O3 |
| Smiles: | Cc1cccc(CN2CCCN(C2=O)c2ccc(cc2)C(Nc2ccc(CCO)cc2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.9796 |
| logD: | 3.9795 |
| logSw: | -4.0804 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.544 |
| InChI Key: | ZPHPOMXMUQYQOG-UHFFFAOYSA-N |