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Telmisartan Dimer Impurity

CAT: 1596-AR-T01383-04Size: 100 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-T01383-04Size:100 Units
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CAS Number
884330-14-7
Synonyms
4',4'''- ((7'-methyl-2'-propyl-1H,3'H-[2,5'-bibenzo[d]imidazole]-1,3'-diyl) bis (methylene) ) bis (([1,1'-biphenyl]-2-carboxylic acid) ) ; 4',4'''-[ (4'-Methyl-2'-propyl[2,6'-bi-1H-benzimidazole]-1,1'-diyl) bis (methylene) ]bis[1,1'-biphenyl]-2-carboxylic Acid
Molecular Formula
C46H38N4O4
Molecular Weight
710.84
API Name
Telmisartan

Chemical Information

Telmisartan Dimer Impurity
CAS Number884330-14-7
PubChem CID59027207
IUPAC Name2-[4-[[2-[3-[[4-(2-carboxyphenyl)phenyl]methyl]-7-methyl-2-propylbenzimidazol-5-yl]benzimidazol-1-yl]methyl]phenyl]benzoic acid
Molecular FormulaC46H38N4O4
Molecular Weight710.8
XLogP9.7
Topological Polar Surface Area110
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count11
Heavy Atom Count54
Formal Charge0
Complexity1250
SMILES
CCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C=C(C=C2C)C5=NC6=CC=CC=C6N5CC7=CC=C(C=C7)C8=CC=CC=C8C(=O)O
InChI
InChI=1S/C46H38N4O4/c1-3-10-42-48-43-29(2)25-34(26-41(43)49(42)27-30-17-21-32(22-18-30)35-11-4-6-13-37(35)45(51)52)44-47-39-15-8-9-16-40(39)50(44)28-31-19-23-33(24-20-31)36-12-5-7-14-38(36)46(53)54/h4-9,11-26H,3,10,27-28H2,1-2H3,(H,51,52)(H,53,54)
InChIKey
CEZAWGSRRZSCPG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Telmisartan Dimer Impurity
CAS: 884330-14-7
CID: 59027207
Formula: C46H38N4O4
MW: 710.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight710.8
XLogP39.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count11
Exact Mass710.28930571
Monoisotopic Mass710.28930571
Topological Polar Surface Area110 Ų
Heavy Atom Count54
Formal Charge0
Complexity1250
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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