4'-Trifluoromethyl-biphenyl-2-carboxylic acid [3-(morpholine4-carbonyl)-quinolin-7-yl]-amide
Basic information
- Standard SMILES
O=C(Nc1ccc2cc(C(=O)N3CCOCC3)cnc2c1)c1ccccc1-c1ccc(C(F)(F)F)cc1- InChIKey
FEMXDFMRJPNETB-UHFFFAOYSA-N- Molecular formula
- C28H22F3N3O3
- Average molar mass
- 505.5 g/mol
- Monoisotopic mass
- 505.16132606
Names & identifiers
- Preferred name
- 4'-Trifluoromethyl-biphenyl-2-carboxylic acid [3-(morpholine4-carbonyl)-quinolin-7-yl]-amide
- IUPAC
- N-[3-(morpholine-4-carbonyl)quinolin-7-yl]-2-[4-(trifluoromethyl)phenyl]benzamide
Names & synonyms
4'-Trifluoromethyl-biphenyl-2-carboxylic acid [3-(morpholine4-carbonyl)-quinolin-7-yl]-amide4'-Trifluoromethyl-biphenyl-2-carboxylic acid [3-(morpholine-4-carbonyl)-quinolin -7-yl]-amide
Database identifiers
- PubChem CID
- 10142014
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 71.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 795
Related reactions
3 records
Compound notes
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