Basic information
- Standard SMILES
CCCCCC(C)N(Cc1cccnc1)C(=O)CSCCCC- InChIKey
QYVARZWHRYUZDR-UHFFFAOYSA-N- Molecular formula
- C19H32N2OS
- Average molar mass
- 336.5 g/mol
Names & identifiers
- Preferred name
- N-(1-methylhexyl)-N-[(3-pyridyl)methyl]-alpha-(n-butylthio)acetamide
- IUPAC
- 2-butylsulfanyl-N-heptan-2-yl-N-(pyridin-3-ylmethyl)acetamide
Names & synonyms
SCHEMBL10988429QYVARZWHRYUZDR-UHFFFAOYSA-NN-(1-methylhexyl)-N-[(3-pyridyl)methyl]-alpha-(n-butylthio)acetamide
Database identifiers
- PubChem CID
- 13652437
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 58.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 12
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 312
Related reactions
2 records
Compound notes
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