17-[(adamantan-1-yl)methyl]-1,8-dibromo-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-[(adamantan-1-yl)methyl]-1,8-dibromo-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-[(adamantan-1-yl)methyl]-1,8-dibromo-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: | 8007-2769 |
| Compound Name: | 17-[(adamantan-1-yl)methyl]-1,8-dibromo-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: | 581.35 |
| Molecular Formula: | C29 H27 Br2 N O2 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)CN1C(C2C(C1=O)C1(c3ccccc3C2(c2ccccc12)[Br])[Br])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.941 |
| logD: | 6.941 |
| logSw: | -6.1787 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.0943 |
| InChI Key: | NROMMYPMHDAGLZ-UHFFFAOYSA-N |