Deoxysotalol
Completing data — refresh the page later to see the latest
Basic information
- CAS
16974-42-8- Standard SMILES
CC(C)NCCc1ccc(NS(C)(=O)=O)cc1- InChIKey
HCLCHPYEDZTGMF-UHFFFAOYSA-N- Molecular formula
- C12H20N2O2S
- Average molar mass
- 256.37 g/mol
- Monoisotopic mass
- 256.12454906
Overview
RN given refers to parent cpd
Names & identifiers
- Preferred name
- Deoxysotalol
- IUPAC
- N-[4-[2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide
- English name
- Sotalol EP Impurity A
- Molecular formula
- C12H20N2O2S
- Molecular weight
- 256.36
Names & synonyms
Deoxysotalol16974-42-82O703211HLMethanesulfonamide, N-(4-(2-((1-methylethyl)amino)ethyl)phenyl)-DTXSID70168742RefChem:132001DTXCID4091233N-[4-[2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamideSotalol Impurity A;N-(4-{2-[(propan-2-yl)amino]ethyl}phenyl)methanesulfonamideSotalol EP Impurity AUNII-2O703211HL
Show more names
Sotalol Impurity 1(Sotalol EP Impurity A）Sotalol Related Compound-C / Sotalol EP Impurity-AN-[4-[2-[(1- Methylethyl)amino]ethyl]phenyl]methanesulphonamideMethanesulfonamide, N-[4-[2-[(1-methylethyl)amino]ethyl]phenyl]-
SCHEMBL17143188Sotalol Hydrochloride EP Impurity AQ27255196SOTALOL HYDROCHLORIDE IMPURITY A [EP IMPURITY]N-(4-(2-(isopropylamino)ethyl)phenyl)methanesulfonamide
Database identifiers
- CAS
16974-42-8- PubChem CID
- 167600
- DTXSID
DTXSID70168742- UNII
- 2O703211HL
Properties
Computed structural propertiesFilling in
- XLogP
- 1.5
- Topological polar surface area
- 66.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 301
Physicochemical properties
- Melting point
- 153 · 153-155°C
- Boiling point
- 381.9 · 381.9±44.0 °C(Predicted)
- Density
- 1.157 · 1.157±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C Freezer, Under inert atmosphere
- solubility
- DMSO (Slightly, Heated), Methanol (Slightly)
- pka
- 8.61 · 8.61±0.10(Predicted)
- form
- Solid
- color
- Off-White
- FDA UNII
- 2 O703211HL · 2O703211HL
- HS Code
- 2935909550 · 2935909550
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2935909550
Chemistry & industry
Applications
UsesDeoxysotalol is the metabolite of Sotalol (S677300), a potent α-adrenergic receptor antagonist and A class III antiarrythmic. Several studies have examined deoxysotalol on its effects on prostaglandin (PGF2a and 15-methyl PGF2α)-evoked contraction using isolated rat uterus and also in potentiating the contractile effects of Oxytocin (O878500).
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…