Molecular Identity
formoterol
N-[2-hydroxy-5-[1-hydroxy-2-[1-(4-methoxyphenyl)propan-2-ylamino]ethyl]phenyl]formamide
PubChem CID: 3410
N-[2-hydroxy-5-(1-hydroxy-2-{[1-(4-methoxyphenyl)propan-2-yl]amino}ethyl)phenyl]formamide is a phenylethanoloamine having 4-hydroxy and 3-formamido substituents on the phenyl ring and an N-(4-methoxyphenyl)propan-2-yl substituent. It is a member of formamides, a member of phenylethanolamines, a member of phenols, a secondary alcohol and a secondary amino compound.
2D Structure
Properties
C19H24N2O4
Molecular Formula
344.40
Molecular Weight
g/mol
344.1736
Exact Mass
Da
1.8
XLogP
Drug-like (Lipinski: < 5)
90.8
TPSA
Good oral absorption (< 140 A²)
4
H-Bond Donors
5
H-Bond Acceptors
388
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
formoterol73573-87-2OxisFormoterolumN-[2-hydroxy-5-[1-hydroxy-2-[1-(4-methoxyphenyl)propan-2-ylamino]ethyl]phenyl]formamide(+-)-Formoterol2'-hydroxy-5'-(1-hydroxy-2-((p-methoxy-alpha-methylphenethyl)amino)ethyl)formanilide2'-hydroxy-5'-{1-hydroxy-2-[(p-methoxy-alpha-methylphenethyl)amino]ethyl}formanilideDTXSID1023077N-(2-hydroxy-5-(1-hydroxy-2-(1-(4-methoxyphenyl)propan-2-ylamino)ethyl)phenyl)formamide(+-)-2'-Hydroxy-5'-((RS)-1-hydroxy-2-(((RS)-p-methoxy-alpha-methylphenethyl)amino)ethyl)formanilideRefChem:5843CHEBI:5147DTXCID4065311R03AC13
Data from PubChem (NCBI)
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