4-[(4-methylphenyl)methyl]-2-{[4-(morpholine-4-carbonyl)phenyl]methylidene}-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-[(4-methylphenyl)methyl]-2-{[4-(morpholine-4-carbonyl)phenyl]methylidene}-2H-1,4-benzoxazin-3(4H)-one
4-[(4-methylphenyl)methyl]-2-{[4-(morpholine-4-carbonyl)phenyl]methylidene}-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | K788-5758 |
| Compound Name: | 4-[(4-methylphenyl)methyl]-2-{[4-(morpholine-4-carbonyl)phenyl]methylidene}-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 454.53 |
| Molecular Formula: | C28 H26 N2 O4 |
| Smiles: | Cc1ccc(CN2C(/C(=C\c3ccc(cc3)C(N3CCOCC3)=O)Oc3ccccc23)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1913 |
| logD: | 4.1913 |
| logSw: | -4.3544 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.59 |
| InChI Key: | BEKQQPREICXLNR-NLRVBDNBSA-N |