N-[1-(adamantan-1-yl)propyl]-1-nitro-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
Chemical Structure Depiction of
N-[1-(adamantan-1-yl)propyl]-1-nitro-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
N-[1-(adamantan-1-yl)propyl]-1-nitro-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
Compound characteristics
| Compound ID: | 8015-9013 |
| Compound Name: | N-[1-(adamantan-1-yl)propyl]-1-nitro-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide |
| Molecular Weight: | 472.54 |
| Molecular Formula: | C28 H28 N2 O5 |
| Smiles: | CCC(C12CC3CC(CC(C3)C2)C1)NC(c1ccc2C(c3ccccc3C(c2c1[N+]([O-])=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7967 |
| logD: | 6.7963 |
| logSw: | -5.9084 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.037 |
| InChI Key: | PEIGCOADANROCK-JHXQMKRWSA-N |