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O-Methyl Losartan

CAT: 0572-TRC-M493300-100MGSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-M493300-100MGSize:100 mg
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CAS Number
114798-94-6
Synonyms
Losartan Methyl Ether
Hazard Statement
No Data Available
Smiles
CCCCc1nc(Cl)c(COC)n1Cc2ccc(cc2)c3ccccc3c4nnn[nH]4
Molecular Formula
C23 H25 Cl N6 O
Molecular Weight
436.94
InChI
InChI=1S/C23H25ClN6O/c1-3-4-9-21-25-22(24)20(15-31-2)30(21)14-16-10-12-17(13-11-16)18-7-5-6-8-19(18)23-26-28-29-27-23/h5-8,10-13H,3-4,9,14-15H2,1-2H3,(H,26,27,28,29)
Additionnal Information
IUPAC name: 5-[2-[4-[[2-butyl-4-chloro-5-(methoxymethyl)imidazol-1-yl]methyl]phenyl]phenyl]-1H-tetrazole
Shipping Conditions
Room Temperature

Chemical Information

Losartan Methyl Ether
CAS Number114798-94-6
PubChem CID44319594
IUPAC Name5-[2-[4-[[2-butyl-4-chloro-5-(methoxymethyl)imidazol-1-yl]methyl]phenyl]phenyl]-2H-tetrazole
Molecular FormulaC23H25ClN6O
Molecular Weight436.9
XLogP4.8
Topological Polar Surface Area81.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Heavy Atom Count31
Formal Charge0
Complexity534
SMILES
CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C4=NNN=N4)COC)Cl
InChI
InChI=1S/C23H25ClN6O/c1-3-4-9-21-25-22(24)20(15-31-2)30(21)14-16-10-12-17(13-11-16)18-7-5-6-8-19(18)23-26-28-29-27-23/h5-8,10-13H,3-4,9,14-15H2,1-2H3,(H,26,27,28,29)
InChIKey
HPHOQTPUEWOTNY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Losartan Methyl Ether
CAS: 114798-94-6
CID: 44319594
Formula: C23H25ClN6O
MW: 436.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight436.9
XLogP34.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Exact Mass436.1778371
Monoisotopic Mass436.1778371
Topological Polar Surface Area81.5 Ų
Heavy Atom Count31
Formal Charge0
Complexity534
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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