Basic information
- Standard SMILES
CCCCCCN(CCCCCC)C1=NS(=O)(=O)N=C1OCC- InChIKey
FOEJQRJQIKVUQJ-UHFFFAOYSA-N- Molecular formula
- C16H31N3O3S
- Average molar mass
- 345.5 g/mol
Names & identifiers
- Preferred name
- 4-(N,N-di-n-hexylamino)-3-ethoxy-1,1-dioxo-1,2,5-thiadiazole
- IUPAC
- 4-ethoxy-N,N-dihexyl-1,1-dioxo-1,2,5-thiadiazol-3-amine
Names & synonyms
SCHEMBL2059086FOEJQRJQIKVUQJ-UHFFFAOYSA-N4-(N,N-di-n-hexylamino)-3-ethoxy-1,1-dioxo-1,2,5-thiadiazole
Database identifiers
- PubChem CID
- 22138787
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 79.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 13
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 483
Related reactions
26 records
Compound notes
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