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Basic information
- Standard SMILES
COc1ccc(COCCCNc2nccc(-c3c(-c4ccc(F)cc4)nn4cc(C(F)(F)F)ccc34)n2)cc1- InChIKey
AFWVWSHLIQUPQC-UHFFFAOYSA-N- Molecular formula
- C29H25F4N5O2
- Average molar mass
- 551.5 g/mol
Names & identifiers
- Preferred name
- 4-[2-(4-fluorophenyl)-6-trifluoromethylpyrazolo[1,5-a]pyridin-3-yl]-N-(3-(4-methoxybenzyloxy)propyl)-2-pyrimidinamine
- IUPAC
- 4-[2-(4-fluorophenyl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyridin-3-yl]-N-[3-[(4-methoxyphenyl)methoxy]propyl]pyrimidin-2-amine
Names & synonyms
4-[2-(4-fluorophenyl)-6-trifluoromethylpyrazolo[1,5-a]pyridin-3-yl]-N-(3-(4-methoxybenzyloxy)propyl)-2-pyrimidinamineSCHEMBL5389214
Database identifiers
- PubChem CID
- 21076972
Properties
Computed structural propertiesFilling in
- XLogP
- 5.6
- Topological polar surface area
- 73.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 10
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 763
Related reactions
3 records
Compound notes
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