2-{[4-(4-benzylpiperidine-1-carbonyl)phenyl]methylidene}-4-[(4-methylphenyl)methyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
2-{[4-(4-benzylpiperidine-1-carbonyl)phenyl]methylidene}-4-[(4-methylphenyl)methyl]-2H-1,4-benzoxazin-3(4H)-one
2-{[4-(4-benzylpiperidine-1-carbonyl)phenyl]methylidene}-4-[(4-methylphenyl)methyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | K788-5747 |
| Compound Name: | 2-{[4-(4-benzylpiperidine-1-carbonyl)phenyl]methylidene}-4-[(4-methylphenyl)methyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 542.68 |
| Molecular Formula: | C36 H34 N2 O3 |
| Smiles: | Cc1ccc(CN2C(/C(=C\c3ccc(cc3)C(N3CCC(CC3)Cc3ccccc3)=O)Oc3ccccc23)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 7.3209 |
| logD: | 7.3209 |
| logSw: | -5.8542 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.41 |
| InChI Key: | VJTCWOYBKHDUTJ-UHFFFAOYSA-N |