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Formoterol EP Impurity E

CAT: 1299-RM-F132005-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-F132005-02Size:25 mg
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CAS Number
1616967-26-0
Synonyms
N- (2-hydroxy-5- (1-hydroxy-2- ((1- (4-methoxy-3-methylphenyl) propan-2-yl) amino) ethyl) phenyl) formamide
Molecular Formula
C20H26N2O4
Molecular Weight
358.43
Target Alternative Name
Formoterol
Product Name Synonym
N- (2-hydroxy-5- (1-hydroxy-2- ((1- (4-methoxy-3-methylphenyl) propan-2-yl) amino) ethyl) phenyl) formamide

Chemical Information

N-[2-hydroxy-5-(1-hydroxy-2-{[2-(4-methoxy-3-methylphenyl)-1-methylethyl]amino}ethyl)phenyl]formamide
CAS Number1616967-26-0
PubChem CID71750278
IUPAC NameN-[2-hydroxy-5-[1-hydroxy-2-[1-(4-methoxy-3-methylphenyl)propan-2-ylamino]ethyl]phenyl]formamide
Molecular FormulaC20H26N2O4
Molecular Weight358.4
XLogP2.2
Topological Polar Surface Area90.8
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Heavy Atom Count26
Formal Charge0
Complexity423
SMILES
CC1=C(C=CC(=C1)CC(C)NCC(C2=CC(=C(C=C2)O)NC=O)O)OC
InChI
InChI=1S/C20H26N2O4/c1-13-8-15(4-7-20(13)26-3)9-14(2)21-11-19(25)16-5-6-18(24)17(10-16)22-12-23/h4-8,10,12,14,19,21,24-25H,9,11H2,1-3H3,(H,22,23)
InChIKey
KMTQWBVDHUNFES-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-[2-hydroxy-5-(1-hydroxy-2-{[2-(4-methoxy-3-methylphenyl)-1-methylethyl]amino}ethyl)phenyl]formamide
CAS: 1616967-26-0
CID: 71750278
Formula: C20H26N2O4
MW: 358.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight358.4
XLogP32.2
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Exact Mass358.18925731
Monoisotopic Mass358.18925731
Topological Polar Surface Area90.8 Ų
Heavy Atom Count26
Formal Charge0
Complexity423
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes