17-(2-bromophenyl)-8-methyl-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-1-carbaldehyde
Chemical Structure Depiction of
17-(2-bromophenyl)-8-methyl-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-1-carbaldehyde
17-(2-bromophenyl)-8-methyl-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-1-carbaldehyde
Compound characteristics
| Compound ID: | 8009-0214 |
| Compound Name: | 17-(2-bromophenyl)-8-methyl-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-1-carbaldehyde |
| Molecular Weight: | 472.34 |
| Molecular Formula: | C26 H18 Br N O3 |
| Smiles: | CC12C3C(C(N(C3=O)c3ccccc3[Br])=O)C(C=O)(c3ccccc13)c1ccccc12 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8902 |
| logD: | 3.8901 |
| logSw: | -4.0951 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.308 |
| InChI Key: | IIDIQRVWHGMZOE-UHFFFAOYSA-N |