Practolol, (S)-

HCID 443371

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 37936-65-5
Standard SMILES: CC(=O)Nc1ccc(OC[C@@H](O)CNC(C)C)cc1
InChIKey: DURULFYMVIFBIR-ZDUSSCGKSA-N
Molecular formula: C14H22N2O3
Average molar mass: 266.34 g/mol
Monoisotopic mass: 266.16304257

Names & identifiers

Preferred name: Practolol, (S)-
IUPAC: N-[4-[(2S)-2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]acetamide

Names & synonyms

(S)-Practolol(-)-PractololPractolol, (S)-520384CS0Q37936-65-5(-)-1-(4-Acetamidophenoxy)-3-(isopropylamino)-2-propanolN-(4-((2S)-2-Hydroxy-3-((1-methylethyl)amino)propoxy)phenyl)acetamideAcetamide, N-(4-((2S)-2-hydroxy-3-((1-methylethyl)amino)propoxy)phenyl)-Acetamide, N-(4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)phenyl)-, (S)-RefChem:1096575Tocris-0831UNII-520384CS0Q

Show more names

Prestwick_742Spectrum_001454Eralzdin PractololCAS-6673-35-4AC1Q1QBZSCHEMBL39926CHEMBL1358416EBC-08037

Database identifiers

CAS: 37936-65-5
PubChem CID: 443371
ChEMBL: CHEMBL1358416
UNII: 520384CS0Q
Nikkaji: J1.376.446H

Properties

Computed structural properties

XLogP: 0.8
Topological polar surface area: 70.6 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 4
Rotatable bonds: 7
Heavy atoms: 19
Formal charge: 0
Complexity: 263

Experimental & physicochemical properties

DrugsPharmaceuticals -> Listed in ZINC15

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…