Basic information
- Standard SMILES
COc1cc(CNc2nc3c(NC(C)=O)cc(C(F)(F)F)cc3nc2-c2ccccc2)cc(OC)c1OC- InChIKey
BOWSLYROWDLPPJ-UHFFFAOYSA-N- Molecular formula
- C27H25F3N4O4
- Average molar mass
- 526.5 g/mol
- Monoisotopic mass
- 526.18278978
Names & identifiers
- Preferred name
- N-(2-Phenyl-7-(trifluoromethyl)-3-((3,4,5-trimethoxybenzyl)amino)-5-quinoxalinyl)acetamide
- IUPAC
- N-[2-phenyl-7-(trifluoromethyl)-3-[(3,4,5-trimethoxyphenyl)methylamino]quinoxalin-5-yl]acetamide
Names & synonyms
NSC642078CHEMBL1999994NSC-642078N-(2-Phenyl-7-(trifluoromethyl)-3-((3,4,5-trimethoxybenzyl)amino)-5-quinoxalinyl)acetamideN-[2-phenyl-7-(trifluoromethyl)-3-[(3,4,5-trimethoxyphenyl)methylamino]quinoxalin-5-yl]acetamideNCI60_014279
Database identifiers
- PubChem CID
- 369884
- ChEMBL
CHEMBL1999994- Nikkaji
- J779.653F
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 94.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 8
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 755
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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