4-Pyrimidinamine, 2-((4-fluorophenyl)thio)-6-(1-methylpropoxy)-
Basic information
- CAS
284681-54-5- Standard SMILES
CCC(C)Oc1cc(N)nc(Sc2ccc(F)cc2)n1- InChIKey
UURKELCZHKBJLY-UHFFFAOYSA-N- Molecular formula
- C14H16FN3OS
- Average molar mass
- 293.36 g/mol
- Monoisotopic mass
- 293.09981148
Names & identifiers
- Preferred name
- 4-Pyrimidinamine, 2-((4-fluorophenyl)thio)-6-(1-methylpropoxy)-
- IUPAC
- 6-butan-2-yloxy-2-(4-fluorophenyl)sulfanylpyrimidin-4-amine
Names & synonyms
284681-54-56-sec-Butoxy-2-(4-fluoro-phenylsulfanyl)-pyrimidin-4-ylamine4-Pyrimidinamine, 2-((4-fluorophenyl)thio)-6-(1-methylpropoxy)-4-Pyrimidinamine, 2-[(4-fluorophenyl)thio]-6-(1-methylpropoxy)-RefChem:2960866-(sec-Butoxy)-2-((4-fluorophenyl)thio)pyrimidin-4-amineDTXSID609511202-(4-fluorophenyl)sulfanyl-6-sec-butoxy-pyrimidin-4-amine6-(s-butoxy)-2-((4-fluorophenyl)thio)pyrimidin-4-amine6-[(Butan-2-yl)oxy]-2-[(4-fluorophenyl)sulfanyl]pyrimidin-4-amine
Database identifiers
- CAS
284681-54-5- PubChem CID
- 478095
- DTXSID
DTXSID60951120- Nikkaji
- J1.320.168D
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 86.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 290
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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