Acetamide, N-(4,7-dimethoxy-6-(2-(1-pyrrolidinyl)ethoxy)-5-benzofuranyl)-, methanesulfonate
Basic information
- CAS
66203-11-0- Standard SMILES
COc1c(NC(C)=O)c(OCCN2CCCC2)c(OC)c2occc12.CS(=O)(=O)O- InChIKey
JSCHKSPCSCECKJ-UHFFFAOYSA-N- Molecular formula
- C19H28N2O8S
- Average molar mass
- 444.5 g/mol
- Monoisotopic mass
- 444.15663703
Names & identifiers
- Preferred name
- Acetamide, N-(4,7-dimethoxy-6-(2-(1-pyrrolidinyl)ethoxy)-5-benzofuranyl)-, methanesulfonate
- IUPAC
- N-[4,7-dimethoxy-6-(2-pyrrolidin-1-ylethoxy)-1-benzofuran-5-yl]acetamide;methanesulfonic acid
Names & synonyms
Acetamide, N-(4,7-dimethoxy-6-(2-(1-pyrrolidinyl)ethoxy)-5-benzofuranyl)-, methanesulfonate66203-11-0N-(4,7-Dimethoxy-6-(2-pyrrolidinylethoxy)-5-benzofuranyl)acetamide methanesulfonateDTXSID20216388RefChem:315216DTXCID20138879Methanesulfonic acid--N-{4,7-dimethoxy-6-[2-(pyrrolidin-1-yl)ethoxy]-1-benzofuran-5-yl}acetamide (1/1)
Database identifiers
- CAS
66203-11-0- PubChem CID
- 47853
- DTXSID
DTXSID20216388
Properties
Computed structural properties
- Topological polar surface area
- 136 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 536
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Compound notes
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