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Basic information
- Standard SMILES
COc1ccc(Nc2ccc(Cc3c[nH]c4ncc(C)cc34)c(F)n2)cn1- InChIKey
KHOGALDQMOVCQY-UHFFFAOYSA-N- Molecular formula
- C20H18FN5O
- Average molar mass
- 363.4 g/mol
Names & identifiers
- Preferred name
- [6-Fluoro-5-(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-ylmethyl)-pyridin-2-yl]-(6-methoxy-pyridin-3-yl)-amine
- IUPAC
- 6-fluoro-N-(6-methoxy-3-pyridinyl)-5-[(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]pyridin-2-amine
Names & synonyms
SCHEMBL2538810KHOGALDQMOVCQY-UHFFFAOYSA-N[6-Fluoro-5-(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-ylmethyl)-pyridin-2-yl]-(6-methoxy-pyridin-3-yl)-amine
Database identifiers
- PubChem CID
- 54589367
Properties
Computed structural propertiesFilling in
- XLogP
- 4.1
- Topological polar surface area
- 75.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 483
Related reactions
2 records
Compound notes
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