Meobentine Sulfate
Basic information
- CAS
58503-79-0- Standard SMILES
CN=C(NC)NCc1ccc(OC)cc1.CN=C(NC)NCc1ccc(OC)cc1.O=S(=O)(O)O- InChIKey
LVEGWDSAJVVBHT-UHFFFAOYSA-N- Molecular formula
- C22H36N6O6S
- Average molar mass
- 512.6 g/mol
- Monoisotopic mass
- 512.24170406
Names & identifiers
- Preferred name
- Meobentine Sulfate
- IUPAC
- bis(1-[(4-methoxyphenyl)methyl]-2,3-dimethylguanidine);sulfuric acid
- English name
- Meobentine sulfate
- Molecular formula
- C22H36N6O6S
- Molecular weight
- 512.62284
Names & synonyms
MEOBENTINE SULFATEmeobentine sulphate58503-79-0D6BKO039M0DTXSID10207225RefChem:156499DTXCID10129716Meobentine sulfate [USAN]1-(p-Methoxybenzyl)-2,3-dimethylguanidine sulfate (2:1)Meobentine sulfate (USAN)Meobentin sulfatGuanidine, N-((4-methoxyphenyl)methyl)-N',N''-dimethyl-, sulfate (2:1)
Show more names
UNII-D6BKO039M0SCHEMBL1650297MEOBENTINE SULFATE [MI]CHEMBL39897831-[(4-methoxyphenyl)methyl]-2,3-dimethylguanidine;sulfuric acidNS00125385D04920Q27276170
Database identifiers
- CAS
58503-79-0- PubChem CID
- 42764
- DTXSID
DTXSID10207225- ChEMBL
CHEMBL3989783- UNII
- D6BKO039M0
Properties
Computed structural properties
- Topological polar surface area
- 174 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 10
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 279
Physicochemical properties
- Melting point
- 273 · 273-274°
- FDA UNII
- 6 BKO039M0 · D6BKO039M0
Chemistry & industry
Applications
UsesCardiac depressant (anti-arrhythmic).
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Related reactions
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Compound notes
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