4-[(3-fluorophenyl)methyl]-2-({4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl}methylidene)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-[(3-fluorophenyl)methyl]-2-({4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl}methylidene)-2H-1,4-benzoxazin-3(4H)-one
4-[(3-fluorophenyl)methyl]-2-({4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl}methylidene)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | K788-5956 |
| Compound Name: | 4-[(3-fluorophenyl)methyl]-2-({4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl}methylidene)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 563.63 |
| Molecular Formula: | C34 H30 F N3 O4 |
| Smiles: | COc1ccccc1N1CCN(CC1)C(c1ccc(/C=C2/C(N(Cc3cccc(c3)F)c3ccccc3O2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6848 |
| logD: | 5.6848 |
| logSw: | -5.4785 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.271 |
| InChI Key: | QEUBASHQZFEPCH-UHFFFAOYSA-N |