Basic information
- Standard SMILES
CON=C1C[C@@H](C(=O)NC[C@@H](O)c2ccccc2)N(C(=O)c2ccc(-c3ccccc3Cl)cc2)C1- InChIKey
CECYCJXNLCRXAB-LOSJGSFVSA-N- Molecular formula
- C27H26ClN3O4
- Average molar mass
- 492 g/mol
- Monoisotopic mass
- 491.161184
Names & identifiers
- Preferred name
- (2S,4EZ)-N-[(2S)-2-hydroxy-2-phenylethyl]-4-(methoxyimino)-1-{[2'-chloro[1,1'-biphenyl]-4-yl]carbonyl}-2-pyrrolidinecarboxamide
- IUPAC
- (2S)-1-[4-(2-chlorophenyl)benzoyl]-N-[(2S)-2-hydroxy-2-phenylethyl]-4-methoxyiminopyrrolidine-2-carboxamide
Names & synonyms
SCHEMBL4942430CECYCJXNLCRXAB-LOSJGSFVSA-N(2S,4EZ)-N-[(2S)-2-hydroxy-2-phenylethyl]-4-(methoxyimino)-1- {[2'-chloro[1,1'-biphenyl]-4-yl]carbonyl}-2-pyrrolidinecarboxamide(2S,4EZ)-N-[(2S)-2-hydroxy-2-phenylethyl]-4-(methoxyimino)-1-{[2'-chloro[1,1'-biphenyl]-4-yl]carbonyl}-2-pyrrolidinecarboxamide
Database identifiers
- PubChem CID
- 91019723
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 91.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 749
Related reactions
2 records
Compound notes
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