1,1'-[3-hydroxy-3-methyl-5-(4-methylanilino)-4'-nitro-1,2,3,4-tetrahydro[1,1'-biphenyl]-2,6-diyl]di(ethan-1-one)
Chemical Structure Depiction of
1,1'-[3-hydroxy-3-methyl-5-(4-methylanilino)-4'-nitro-1,2,3,4-tetrahydro[1,1'-biphenyl]-2,6-diyl]di(ethan-1-one)
1,1'-[3-hydroxy-3-methyl-5-(4-methylanilino)-4'-nitro-1,2,3,4-tetrahydro[1,1'-biphenyl]-2,6-diyl]di(ethan-1-one)
Compound characteristics
Compound ID: | 8009-0634 |
Compound Name: | 1,1'-[3-hydroxy-3-methyl-5-(4-methylanilino)-4'-nitro-1,2,3,4-tetrahydro[1,1'-biphenyl]-2,6-diyl]di(ethan-1-one) |
Molecular Weight: | 422.48 |
Molecular Formula: | C24 H26 N2 O5 |
Smiles: | CC(C1C(C(=C(CC1(C)O)Nc1ccc(C)cc1)C(C)=O)c1ccc(cc1)[N+]([O-])=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 3.9483 |
logD: | 3.9445 |
logSw: | -4.0344 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 85.241 |
InChI Key: | GGIPIZZLMZDVBP-UHFFFAOYSA-N |