1,1'-[3-hydroxy-5-(4-methoxyanilino)-3-methyl-3'-nitro-1,2,3,4-tetrahydro[1,1'-biphenyl]-2,6-diyl]di(ethan-1-one)
Chemical Structure Depiction of
1,1'-[3-hydroxy-5-(4-methoxyanilino)-3-methyl-3'-nitro-1,2,3,4-tetrahydro[1,1'-biphenyl]-2,6-diyl]di(ethan-1-one)
1,1'-[3-hydroxy-5-(4-methoxyanilino)-3-methyl-3'-nitro-1,2,3,4-tetrahydro[1,1'-biphenyl]-2,6-diyl]di(ethan-1-one)
Compound characteristics
| Compound ID: | 8010-7927 |
| Compound Name: | 1,1'-[3-hydroxy-5-(4-methoxyanilino)-3-methyl-3'-nitro-1,2,3,4-tetrahydro[1,1'-biphenyl]-2,6-diyl]di(ethan-1-one) |
| Molecular Weight: | 438.48 |
| Molecular Formula: | C24 H26 N2 O6 |
| Smiles: | CC(C1C(C(=C(CC1(C)O)Nc1ccc(cc1)OC)C(C)=O)c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4594 |
| logD: | 3.4536 |
| logSw: | -3.7579 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.784 |
| InChI Key: | XXMZHMRAXAIYGG-UHFFFAOYSA-N |