N-[4-(benzylamino)-9,10-dioxo-9,10-dihydroanthracen-1-yl]-4'-octyl[1,1'-biphenyl]-4-carboxamide
Chemical Structure Depiction of
N-[4-(benzylamino)-9,10-dioxo-9,10-dihydroanthracen-1-yl]-4'-octyl[1,1'-biphenyl]-4-carboxamide
N-[4-(benzylamino)-9,10-dioxo-9,10-dihydroanthracen-1-yl]-4'-octyl[1,1'-biphenyl]-4-carboxamide
Compound characteristics
| Compound ID: | 0052-0099 |
| Compound Name: | N-[4-(benzylamino)-9,10-dioxo-9,10-dihydroanthracen-1-yl]-4'-octyl[1,1'-biphenyl]-4-carboxamide |
| Molecular Weight: | 620.79 |
| Molecular Formula: | C42 H40 N2 O3 |
| Smiles: | CCCCCCCCc1ccc(cc1)c1ccc(cc1)C(Nc1ccc(c2C(c3ccccc3C(c12)=O)=O)NCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 11.4618 |
| logD: | 11.4414 |
| logSw: | -5.9705 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.839 |
| InChI Key: | SDIZFROXJBKVRC-UHFFFAOYSA-N |