17-(2-bromo-4-nitrophenyl)-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-bromo-4-nitrophenyl)-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-bromo-4-nitrophenyl)-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: | 2360-0519 |
| Compound Name: | 17-(2-bromo-4-nitrophenyl)-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: | 475.3 |
| Molecular Formula: | C24 H15 Br N2 O4 |
| Smiles: | c1ccc2C3C4C(C(c2c1)c1ccccc13)C(N(C4=O)c1ccc(cc1[Br])[N+]([O-])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4663 |
| logD: | 4.4663 |
| logSw: | -4.6318 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.53 |
| InChI Key: | HDIITRHIQFCCBV-UHFFFAOYSA-N |