Basic information
- Standard SMILES
CC(C)(C)OC(=O)[C@@H](CC(=O)N1CCn2c(C(F)(F)F)nc(C(=O)O)c2C1)Cc1cc(F)c(F)cc1F- InChIKey
RQBFEWPENLYCCD-GFCCVEGCSA-N- Molecular formula
- C23H23F6N3O5
- Average molar mass
- 535.4 g/mol
Names & identifiers
- Preferred name
- (R)-7-[3-tert-butoxycarbonyl-4-(2,4,5-trifluorophenyl)butanoyl]-3-trifluoromethyl-5,6,7,8-tetrahydro-imidazo[1,5-a]pyrazine-1-carboxylic acid
- IUPAC
- 7-[(3R)-4-[(2-methylpropan-2-yl)oxy]-4-oxo-3-[(2,4,5-trifluorophenyl)methyl]butanoyl]-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid
Names & synonyms
(R)-7-[3-tert-butoxycarbonyl-4-(2,4,5-trifluorophenyl)butanoyl]-3-trifluoromethyl-5,6,7,8-tetrahydro-imidazo[1,5-a]pyrazine-1-carboxylic acidSCHEMBL441413
Database identifiers
- PubChem CID
- 86663124
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 8
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 869
Related reactions
1 records
Compound notes
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