4-fluoro-N'-{(Z)-[17-(2-nitrophenyl)-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-1-yl]methylidene}benzohydrazide
Chemical Structure Depiction of
4-fluoro-N'-{(Z)-[17-(2-nitrophenyl)-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-1-yl]methylidene}benzohydrazide
4-fluoro-N'-{(Z)-[17-(2-nitrophenyl)-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-1-yl]methylidene}benzohydrazide
Compound characteristics
| Compound ID: | K206-0111 |
| Compound Name: | 4-fluoro-N'-{(Z)-[17-(2-nitrophenyl)-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-1-yl]methylidene}benzohydrazide |
| Molecular Weight: | 560.54 |
| Molecular Formula: | C32 H21 F N4 O5 |
| Smiles: | C(/C12C3C(C(c4ccccc14)c1ccccc12)C(N(C3=O)c1ccccc1[N+]([O-])=O)=O)=N/NC(c1ccc(cc1)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7746 |
| logD: | 4.7721 |
| logSw: | -5.0353 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.545 |
| InChI Key: | ZGKPSETYLBDJRF-UHFFFAOYSA-N |