4-Chloro-2-(methylthio)-6-(piperidin-1-yl)pyrimidine
Basic information
- CAS
55199-60-5- Standard SMILES
CSc1nc(Cl)cc(N2CCCCC2)n1- InChIKey
MBMLHMFYKRILAT-UHFFFAOYSA-N- Molecular formula
- C10H14ClN3S
- Average molar mass
- 243.76 g/mol
Names & identifiers
- Preferred name
- 4-Chloro-2-(methylthio)-6-(piperidin-1-yl)pyrimidine
- IUPAC
- 4-chloro-2-methylsulfanyl-6-piperidin-1-ylpyrimidine
- English name
- 4-Chloro-2-(methylthio)-6-(piperidin-1-yl)pyrimidine
- Molecular formula
- C10H14ClN3S
- Molecular weight
- 243.76
Names & synonyms
55199-60-5DB-3055514-Chloro-2-methylthio-6-(piperidin-1-yl)pyrimidine4-chloro-2-(methylthio)-6-(piperidin-1-yl)pyrimidine2-Methylthio-4-chloro-6-piperidinopyrimidine4-Chloro-2-methylthio-6-(1-piperidyl)pyrimidinePyrimidine, 4-chloro-2-(methylthio)-6-(1-piperidinyl)-
Database identifiers
- CAS
55199-60-5
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 54.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 199
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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