(2S,3S)-3-methyl-2-[2-oxo-3-(4-quinolinylmethyl)-1-imidazolidinyl]pentanoic acid trifluoroacetat
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Basic information
- Standard SMILES
CC[C@H](C)[C@@H](C(=O)O)N1CCN(Cc2ccnc3ccccc23)C1=O.O=C(O)C(F)(F)F- InChIKey
AVGQSIFKGTYRTO-KYLFUZKPSA-N- Molecular formula
- C21H24F3N3O5
- Average molar mass
- 455.4 g/mol
Names & identifiers
- Preferred name
- (2S,3S)-3-methyl-2-[2-oxo-3-(4-quinolinylmethyl)-1-imidazolidinyl]pentanoic acid trifluoroacetat
- IUPAC
- (2S,3S)-3-methyl-2-[2-oxo-3-(quinolin-4-ylmethyl)imidazolidin-1-yl]pentanoic acid;2,2,2-trifluoroacetic acid
Names & synonyms
(2S,3S)-3-methyl-2-[2-oxo-3-(4-quinolinylmethyl)-1-imidazolidinyl]pentanoic acid trifluoroacetatSCHEMBL2440059(2s,3s)-3-methyl-2-[2-oxo-3-(4-quinolinylmethyl)-1-imidazolidinyl]pentanoic acid trifluoroacetate
Database identifiers
- PubChem CID
- 67408554
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 582
Related reactions
3 records
Compound notes
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