N-[2-methyl-4-[3-methyl-4-(3-phenylpropanoylamino)phenyl]phenyl]-3-phenylpropanamide
Basic information
- CAS
349640-02-4- Standard SMILES
Cc1cc(-c2ccc(NC(=O)CCc3ccccc3)c(C)c2)ccc1NC(=O)CCc1ccccc1- InChIKey
NEYDTEUNRFFJPZ-UHFFFAOYSA-N- Molecular formula
- C32H32N2O2
- Average molar mass
- 476.6 g/mol
Names & identifiers
- Preferred name
- N-[2-methyl-4-[3-methyl-4-(3-phenylpropanoylamino)phenyl]phenyl]-3-phenylpropanamide
- IUPAC
- N-[2-methyl-4-[3-methyl-4-(3-phenylpropanoylamino)phenyl]phenyl]-3-phenylpropanamide
- English name
- N,N'-(3,3'-dimethylbiphenyl-4,4'-diyl)bis(3-phenylpropanamide)
- Molecular formula
- C32H32N2O2
- Molecular weight
- 476.61
Names & synonyms
Oprea1_219895Oprea1_239459STK093173AKOS000491694N-[2-methyl-4-[3-methyl-4-(3-phenylpropanoylamino)phenyl]phenyl]-3-phenylpropanamideST034588N,N'-(3,3'-dimethylbiphenyl-4,4'-diyl)bis(3-phenylpropanamide)N-{2-methyl-4-[3-methyl-4-(3-phenylpropanoylamino)phenyl]phenyl}-3-phenylpropa namide349640-02-4N,N'-(3,3'-dimethyl-4,4'-biphenyldiyl)bis(3-phenylpropanamide)Benzenepropanamide, N,N'-(3,3'-dimethyl[1,1'-biphenyl]-4,4'-diyl)bis- (9CI)
Database identifiers
- CAS
349640-02-4
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 9
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 624
Physicochemical properties
- Boiling point
- 701.7 · 701.7±60.0 °C(Predicted)
- Density
- 1.168 · 1.168±0.06 g/cm3(Predicted)
- pka
- 14.21 · 14.21±0.70(Predicted)
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