17-(4-methoxy-2-nitrophenyl)-1,8-dimethyl-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione
Chemical Structure Depiction of
17-(4-methoxy-2-nitrophenyl)-1,8-dimethyl-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione
17-(4-methoxy-2-nitrophenyl)-1,8-dimethyl-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione
Compound characteristics
| Compound ID: | 2360-0431 |
| Compound Name: | 17-(4-methoxy-2-nitrophenyl)-1,8-dimethyl-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione |
| Molecular Weight: | 454.48 |
| Molecular Formula: | C27 H22 N2 O5 |
| Smiles: | CC12C3C(C(N(C3=O)c3ccc(cc3[N+]([O-])=O)OC)=O)C(C)(c3ccccc13)c1ccccc12 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.9801 |
| logD: | 3.9801 |
| logSw: | -4.3189 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.773 |
| InChI Key: | YAGTXTCJHDSYLG-UHFFFAOYSA-N |