Formoterol

HCID 3410

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Basic information

CAS: 128954-45-0
Standard SMILES: COc1ccc(CC(C)NCC(O)c2ccc(O)c(NC=O)c2)cc1
InChIKey: BPZSYCZIITTYBL-UHFFFAOYSA-N
Molecular formula: C19H24N2O4
Average molar mass: 344.4 g/mol
Monoisotopic mass: 344.17360725

Names & identifiers

Preferred name: Formoterol
IUPAC: N-[2-hydroxy-5-[1-hydroxy-2-[1-(4-methoxyphenyl)propan-2-ylamino]ethyl]phenyl]formamide
English name: formoterol
Molecular formula: C19H24N2O4
Molecular weight: 344.4

Names & synonyms

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:5843

Show more names

Nicarbazin Impurity 10Formoterol DiastereoisomerForMoterol (Mixture of DiastereoMers)Formamide, N-[2-hydroxy-5-[1-hydroxy-2-[[2-(4-methoxyphenyl)-1-methylethyl]amino]ethyl]phenyl]-Formoterol Fumarate Dihydrate EP Impurity I/Formoterol USP RC I/Formoterol (mixture of Diastereomers)/N-[2-Hydroxy-5-[(1RS)-1-hydroxy-2-[[(1SR)-2-(4-methoxyphenyl)-1-methylethyl]amino]ethyl]phenyl]formamide

CHEBI:5147DTXCID4065311R03AC135ZZ84GCW8BEformoterol128954-45-0n-[2-hydroxy-5-(1-hydroxy-2-{[1-(4-methoxyphenyl)propan-2-yl]amino}ethyl)phenyl]formamideFormoterolum [INN-Latin]

Database identifiers

CAS: 128954-45-0、73573-87-2
PubChem CID: 3410
DTXSID: DTXSID20860603
ChEMBL: CHEMBL1256786
ChEBI: CHEBI:63082
EC Number: 615-991-0、936-018-9

Properties

Computed structural properties

XLogP: 1.8
Topological polar surface area: 90.8 Å²
Hydrogen bond donors: 4
Hydrogen bond acceptors: 5
Rotatable bonds: 8
Heavy atoms: 25
Formal charge: 0
Complexity: 388

Physicochemical properties

Melting point: 66 · 66-69°C (dec.)
Boiling point: 603.2 · 603.2±55.0 °C(Predicted)
Density: 1.233 · 1.233±0.06 g/cm3(Predicted)
storage temp.: -20 °C · -20°C Freezer
solubility: DMSO (Slightly), Methanol (Slightly)
form: Solid
pka: 8.95 · 8.95±0.50(Predicted)
color: Off-White to Light Brown

Chemistry & industry

Applications

UsesFormoterol is a selective β2-adrenergic receptor agonist. Formoterol is used as an antiasthmatic.

Upstream & downstream products

Downstream products

N,O-Dibenzylated formoterol

Suppliers13 total

济南百隆化学有限公司[email protected] · [email protected]

湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]

南京望知星医药科技有限公司18569809817 · [email protected]

广州隽唐科技有限公司020-36607679 13502246435 · [email protected]

上海尺水药物研究有限公司[email protected] 13564957716 · [email protected]

Additional notes · 1 item

DefinitionChEBI: 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 phenols, a member of formamides, a secondary amino compound, a secondary alcohol and a member of phenylethanolamines.