Basic information
- Standard SMILES
Cc1ccnc(C)c1Oc1cc(Sc2ccccn2)cnc1N- InChIKey
YJXZSOZEUQUCQE-UHFFFAOYSA-N- Molecular formula
- C17H16N4OS
- Average molar mass
- 324.4 g/mol
Names & identifiers
- Preferred name
- 3-(2,4-Dimethylpyridin-3-yloxy)-5-(pyridin-2-ylthio)pyridin-2-amine
- IUPAC
- 3-[(2,4-dimethyl-3-pyridinyl)oxy]-5-pyridin-2-ylsulfanylpyridin-2-amine
Names & synonyms
SCHEMBL2661275YJXZSOZEUQUCQE-UHFFFAOYSA-N3-(2,4-Dimethylpyridin-3-yloxy)-5-(pyridin-2-ylthio)pyridin-2-amine
Database identifiers
- PubChem CID
- 67487501
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 99.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 373
Related reactions
2 records
Compound notes
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