Basic information
- Standard SMILES
CCCC1CCc2sccc2C1Nc1nc(CC)cnc1CC- InChIKey
CPLHCENOQRGWPQ-UHFFFAOYSA-N- Molecular formula
- C19H27N3S
- Average molar mass
- 329.5 g/mol
- Monoisotopic mass
- 329.19256905
Names & identifiers
- Preferred name
- 3,6-diethyl-N-(5-propyl-4,5,6,7-tetrahydro-1-benzothiophen-4-yl)pyrazin-2-amine
- IUPAC
- 3,6-diethyl-N-(5-propyl-4,5,6,7-tetrahydro-1-benzothiophen-4-yl)pyrazin-2-amine
Names & synonyms
SCHEMBL6098216
Database identifiers
- PubChem CID
- 22147489
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 66.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 365
Related reactions
1 records
Compound notes
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