Basic information
- Standard SMILES
Nc1n[nH]c2ccnc(-c3ccc(NC(=O)Nc4cc(C(F)(F)F)ccc4F)cc3)c12- InChIKey
GADZHFVSZDIAEM-UHFFFAOYSA-N- Molecular formula
- C20H14F4N6O
- Average molar mass
- 430.4 g/mol
Names & identifiers
- Preferred name
- 1-[4-(3-amino-1H-pyrazolo[4,3-c]pyrid-4-yl)phenyl]-3-(2-fluoro-5-trifluoromethylphenyl)urea
- IUPAC
- 1-[4-(3-amino-1H-pyrazolo[4,3-c]pyridin-4-yl)phenyl]-3-[2-fluoro-5-(trifluoromethyl)phenyl]urea
Names & synonyms
1-[4-(3-amino-1H-pyrazolo[4,3-c]pyrid-4-yl)phenyl]-3-(2-fluoro-5-trifluoromethylphenyl)ureaSCHEMBL1702780
Database identifiers
- PubChem CID
- 11633362
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 629
Related reactions
2 records
Compound notes
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