17-(2,5-dimethylphenyl)-1-nitro-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-(2,5-dimethylphenyl)-1-nitro-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-(2,5-dimethylphenyl)-1-nitro-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: | 8013-2482 |
| Compound Name: | 17-(2,5-dimethylphenyl)-1-nitro-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: | 424.46 |
| Molecular Formula: | C26 H20 N2 O4 |
| Smiles: | Cc1ccc(C)c(c1)N1C(C2C3c4ccccc4C(C2C1=O)(c1ccccc13)[N+]([O-])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3841 |
| logD: | 4.3834 |
| logSw: | -4.5903 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.585 |
| InChI Key: | HYTQEWLPIKHJJG-UHFFFAOYSA-N |