Basic information
- Standard SMILES
CC(=O)OCCNC(=O)[C@H](Cc1ccc(OC(F)F)cc1)NC(=O)c1ccc(OCCC(F)(F)F)cc1- InChIKey
LZBYNNBUBFMAJA-FQEVSTJZSA-N- Molecular formula
- C24H25F5N2O6
- Average molar mass
- 532.5 g/mol
- Monoisotopic mass
- 532.16327733
Names & identifiers
- Preferred name
- 2-[((2S)-3-[4-(Difluoromethoxy)phenyl]-2-{[4-(3,3,3-trifluoropropoxy)benzoyl]amino}propanoyl)amino]ethyl acetate
- IUPAC
- 2-[[(2S)-3-[4-(difluoromethoxy)phenyl]-2-[[4-(3,3,3-trifluoropropoxy)benzoyl]amino]propanoyl]amino]ethyl acetate
Names & synonyms
2-[((2S)-3-[4-(Difluoromethoxy)phenyl]-2-{[4-(3,3,3-trifluoropropoxy)benzoyl]amino}propanoyl)amino]ethyl acetateSCHEMBL4362270
Database identifiers
- PubChem CID
- 69016648
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 14
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 723
Related reactions
1 records
Compound notes
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