17-[2-(dimethylamino)ethyl]-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-(dimethylamino)ethyl]-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-(dimethylamino)ethyl]-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: | 8012-9264 |
| Compound Name: | 17-[2-(dimethylamino)ethyl]-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: | 391.43 |
| Molecular Formula: | C22 H21 N3 O4 |
| Smiles: | CN(C)CCN1C(C2C3c4ccccc4C(C2C1=O)(c1ccccc13)[N+]([O-])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.2099 |
| logD: | 1.5606 |
| logSw: | -2.7942 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.613 |
| InChI Key: | HESADYAFBYKCOB-UHFFFAOYSA-N |