Basic information
- CAS
59954-01-7- Standard SMILES
COC(=O)NCCc1ccc(OCC(O)CNC(C)C)cc1.COC(=O)NCCc1ccc(OCC(O)CNC(C)C)cc1.O=S(=O)(O)O- InChIKey
OUXGIOLQOYAZLS-UHFFFAOYSA-N- Molecular formula
- C32H54N4O12S
- Average molar mass
- 718.9 g/mol
- Monoisotopic mass
- 718.34589434
Overview
See also: Pamatolol (has active moiety).
Names & identifiers
- Preferred name
- Pamatolol Sulfate
- IUPAC
- bis(methyl N-[2-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]ethyl]carbamate);sulfuric acid
- English name
- Pamatolol sulfate
- Molecular formula
- C32H54N4O12S
- Molecular weight
- 718.85576
Names & synonyms
PAMATOLOL SULFATE59954-01-7Pamatolol sulphatePamatolol sulfate [USAN]UNII-1RT2DU4P6T1RT2DU4P6TH 104/08Pamatolol sulfate (USAN)H-104/08Methyl (+-)-(p-(2-hydroxy-3-(isopropylamino)propoxy)phenethyl)carbamate sulfate (salt) (2:1)Carbamic acid, (2-(4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)phenyl)ethyl)-, methyl ester, (+-)-, sulfate (salt) (2:1)RefChem:169812
Show more names
CARBAMIC ACID, (2-(4-(2-HYDROXY-3-((1-METHYLETHYL)AMINO)PROPOXY)PHENYL)ETHYL)-, METHYL ESTER, (+-)-, SULPHATE (SALT) (2:1)METHYL (+-)-(P-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)PHENETHYL)CARBAMATE SULPHATE (SALT) (2:1)SCHEMBL610747CHEMBL3989491DTXSID70975377methyl N-[2-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]ethyl]carbamate;sulfuric acidNS00125649D05345
Database identifiers
- CAS
59954-01-7- PubChem CID
- 43149
- DTXSID
DTXSID70975377- ChEMBL
CHEMBL3989491- UNII
- 1RT2DU4P6T
Properties
Computed structural properties
- Topological polar surface area
- 243 Ų
- Hydrogen bond donors
- 8
- Hydrogen bond acceptors
- 14
- Rotatable bonds
- 20
- Heavy atoms
- 49
- Formal charge
- 0
- Complexity
- 386
Physicochemical properties
- FDA UNII
- 1 RT2DU4P6T · 1RT2DU4P6T
Chemistry & industry
Applications
UsesAnti-adrenergic (β-receptor).
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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