4-[(4-chlorophenyl)methyl]-2-{[4-(4-phenylpiperazine-1-carbonyl)phenyl]methylidene}-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-[(4-chlorophenyl)methyl]-2-{[4-(4-phenylpiperazine-1-carbonyl)phenyl]methylidene}-2H-1,4-benzoxazin-3(4H)-one
4-[(4-chlorophenyl)methyl]-2-{[4-(4-phenylpiperazine-1-carbonyl)phenyl]methylidene}-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | K788-6807 |
| Compound Name: | 4-[(4-chlorophenyl)methyl]-2-{[4-(4-phenylpiperazine-1-carbonyl)phenyl]methylidene}-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 550.06 |
| Molecular Formula: | C33 H28 Cl N3 O3 |
| Smiles: | C1CN(CCN1C(c1ccc(/C=C2/C(N(Cc3ccc(cc3)[Cl])c3ccccc3O2)=O)cc1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.1566 |
| logD: | 6.1566 |
| logSw: | -6.3799 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.941 |
| InChI Key: | ZYFKPLGBEFHEQU-UHFFFAOYSA-N |