Basic information
- Standard SMILES
CCCCOc1ccc(C(=O)NCCCSc2ccncc2)cc1.Cl- InChIKey
FRSJRXWRGLAXOK-UHFFFAOYSA-N- Molecular formula
- C19H25ClN2O2S
- Average molar mass
- 380.9 g/mol
Names & identifiers
- Preferred name
- 4-[3-(4-n-Butoxybenzoylamino)propylthio]pyridine hydrochloride
- IUPAC
- 4-butoxy-N-(3-pyridin-4-ylsulfanylpropyl)benzamide;hydrochloride
Names & synonyms
SCHEMBL8967090FRSJRXWRGLAXOK-UHFFFAOYSA-N4-[3-(4-n-butoxybenzoylamino)propylthio]pyridine hydrochloride
Database identifiers
- PubChem CID
- 19079145
Properties
Computed structural properties
- Topological polar surface area
- 76.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 340
Related reactions
5 records
Compound notes
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