Basic information
- CAS
57526-81-5- Standard SMILES
CC(C)NC[C@H](O)COc1ccc(O)cc1- InChIKey
ADUKCCWBEDSMEB-NSHDSACASA-N- Molecular formula
- C12H19NO3
- Average molar mass
- 225.28 g/mol
- Monoisotopic mass
- 225.13649347
Overview
Prenalterol is an aromatic ether.
Names & identifiers
- Preferred name
- Prenalterol
- IUPAC
- 4-[(2S)-2-hydroxy-3-(propan-2-ylamino)propoxy]phenol
- English name
- PRENALTEROL
- Molecular formula
- C12H19NO3
- Molecular weight
- 225.28
Names & synonyms
Prenalterol57526-81-5(-)-PrenalterolPrenalterolum4-[(2S)-2-hydroxy-3-(propan-2-ylamino)propoxy]phenolM4G34404CXDTXSID8023507Phenol, 4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-, (S)-4-[(2S)-2-hydroxy-3-(isopropylamino)propoxy]phenolPhenol, 4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-A Ba C 50,0054-((2S)-2-hydroxy-3-(isopropylamino)propoxy)phenol
Show more names
h133/22cgp7760bHyprenanPraterolS-Varbian(s)-pheno(S)-PrenalterolPrenalterolprenalterol(S)-4-(2-Hydroxy-3-(isopropylaMino)propoxy)phenol
4-((2S)-2-hydroxy-3-(propan-2-ylamino)propoxy)phenolRefChem:868475ABaC50,005C01CA13KWD2033DTXCID201508621H8062H13322
Database identifiers
- CAS
57526-81-5
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 61.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 179
Experimental & physicochemical properties
DrugsPharmaceuticals -> Metabolite of Atenolol
Physicochemical properties
- Melting point
- 127 · 127-128°
- alpha
- 20 · D20 -1 ±1°; 20Hg +2 ±1° (c = 0.940 in methanol)
- Boiling point
- 398 ℃ · 398℃
- Density
- 1.118 · 1.118
- Flash point
- 194 ℃ · 194℃
- storage temp.
- 2 · 2-8°C
- solubility
- Acetone (Slightly), DMSO (Slightly), Methanol (Slightly)
- form
- Solid
- pka
- 9.5 · pKa 9.5 (Uncertain);10.0 (Uncertain)
- color
- Off-White to Beige
- FDA UNII
- 4 G34404CX · M4G34404CX
- ATC code
- 1 CA13 · C01CA13
Chemistry & industry
Pharmacology
ATC Code
C - Cardiovascular system
QC - Cardiovascular system
MeSH Pharmacological Classification
Agents that have a strengthening effect on the heart or that can increase cardiac output. They may be CARDIAC GLYCOSIDES; SYMPATHOMIMETICS; or other drugs. They are used after MYOCARDIAL INFARCT; CARDIAC SURGICAL PROCEDURES; in SHOCK; or in congestive heart failure (HEART FAILURE).
Drugs that mimic the effects of stimulating postganglionic adrenergic sympathetic nerves. Included here are drugs that directly stimulate adrenergic receptors and drugs that act indirectly by provoking the release of adrenergic transmitters.
Compounds that bind to and activate ADRENERGIC BETA-1 RECEPTORS.
Applications
UsesPrenalterol is a β1-adrenergic agonist and used as an cardiotonic (1,2,3).
UsesPrenalterol is a β1-adrenergic agonist. Prenalterol is used as an cardiotonic.
Suppliers13 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
艾吉析科技（上海）有限公司17717235263 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
LGM Pharma1-(800)-881-8210 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
凯试（上海）科技有限公司
Related reactions
3 records
Compound notes
Loading…