Basic information
- Standard SMILES
CN(Cc1ccccc1)C1=N[C@@H](c2ccccc2)[C@@H](c2ccccc2)N1C(=O)OC(C)(C)C- InChIKey
VRLXCFZJDBHVEV-LOSJGSFVSA-N- Molecular formula
- C28H31N3O2
- Average molar mass
- 441.6 g/mol
Names & identifiers
- Preferred name
- 2-(N-Methylbenzylamino)-cis-4,5-diphenyl-4,5-dihydro-imidazole-1-carboxylic Acid Tert-Butyl Ester
- IUPAC
- tert-butyl (4S,5R)-2-[benzyl(methyl)amino]-4,5-diphenyl-4,5-dihydroimidazole-1-carboxylate
Names & synonyms
SCHEMBL3256496VRLXCFZJDBHVEV-LOSJGSFVSA-N2-(N-Methylbenzylamino)-cis-4,5-diphenyl-4,5-dihydro-imidazole-1-carboxylic Acid Tert-Butyl Ester
Database identifiers
- PubChem CID
- 68569769
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 45.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 667
Related reactions
4 records
Compound notes
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