N-(1,8-dibromo-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)-2-methylbenzamide
Chemical Structure Depiction of
N-(1,8-dibromo-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)-2-methylbenzamide
N-(1,8-dibromo-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)-2-methylbenzamide
Compound characteristics
| Compound ID: | 8009-7240 |
| Compound Name: | N-(1,8-dibromo-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)-2-methylbenzamide |
| Molecular Weight: | 566.25 |
| Molecular Formula: | C26 H18 Br2 N2 O3 |
| Smiles: | Cc1ccccc1C(NN1C(C2C(C1=O)C1(c3ccccc3C2(c2ccccc12)[Br])[Br])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.1564 |
| logD: | 3.279 |
| logSw: | -4.3336 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.462 |
| InChI Key: | TYKPUPVOQNFYBG-UHFFFAOYSA-N |