Basic information
- Standard SMILES
C[C@H](Nc1cc(OCCO)cc(Nc2cnccn2)n1)c1ccc(F)cc1- InChIKey
LWPASYMORFEOKT-ZDUSSCGKSA-N- Molecular formula
- C19H20FN5O2
- Average molar mass
- 369.4 g/mol
Names & identifiers
- Preferred name
- (S)-2-{2-[1-(4-fluorophenyl)ethylamino]-6-(pyrazin-2-ylamino)pyridin-4-yloxy}ethanol
- IUPAC
- 2-[[2-[[(1S)-1-(4-fluorophenyl)ethyl]amino]-6-(pyrazin-2-ylamino)-4-pyridinyl]oxy]ethanol
Names & synonyms
SCHEMBL1367512LWPASYMORFEOKT-ZDUSSCGKSA-N(S)-2-{2-[1-(4-fluorophenyl)ethylamino]-6-(pyrazin-2-ylamino) pyridin-4-yloxy}ethanol(S)-2-{2-[1-(4-fluorophenyl)ethylamino]-6-(pyrazin-2-ylamino)pyridin-4-yloxy}ethanol
Database identifiers
- PubChem CID
- 46866428
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 92.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 425
Related reactions
2 records
Compound notes
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