N,N'-(6,12-diphenyldibenzo[b,f][1,5]diazocine-2,8-diyl)di(adamantane-1-carboxamide)
Chemical Structure Depiction of
N,N'-(6,12-diphenyldibenzo[b,f][1,5]diazocine-2,8-diyl)di(adamantane-1-carboxamide)
N,N'-(6,12-diphenyldibenzo[b,f][1,5]diazocine-2,8-diyl)di(adamantane-1-carboxamide)
Compound characteristics
| Compound ID: | 0590-0405 |
| Compound Name: | N,N'-(6,12-diphenyldibenzo[b,f][1,5]diazocine-2,8-diyl)di(adamantane-1-carboxamide) |
| Molecular Weight: | 712.94 |
| Molecular Formula: | C48 H48 N4 O2 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)C(Nc1ccc2c(c1)C(\c1ccccc1)=N/c1ccc(cc1C(\c1ccccc1)=N/2)NC(C12CC3CC(CC(C3)C2)C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 9.9968 |
| logD: | 6.0779 |
| logSw: | -6.2944 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.142 |
| InChI Key: | DCQBAFZRSGPVFI-UHFFFAOYSA-N |