N-(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)adamantane-1-carboxamide
Chemical Structure Depiction of
N-(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)adamantane-1-carboxamide
N-(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)adamantane-1-carboxamide
Compound characteristics
| Compound ID: | 8008-2423 |
| Compound Name: | N-(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)adamantane-1-carboxamide |
| Molecular Weight: | 452.55 |
| Molecular Formula: | C29 H28 N2 O3 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)C(NN1C(C2C(C3c4ccccc4C2c2ccccc23)C1=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4825 |
| logD: | 4.246 |
| logSw: | -4.638 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.495 |
| InChI Key: | QQZQZWVJAQTINL-UHFFFAOYSA-N |