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    CAS 88150-62-3
    Also known as: Phthaloyl amlodipine, 88150-62-3, Phthaloylamlodipine, (+/-)-phthalimidoamlodipine, 3-ethyl 5-methyl 4-(2-chlorophenyl)-2-((2-(1,3-dioxoisoindolin-2-yl)ethoxy)methyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate, 9qao5crp93
    Molecular Formula
    C28H27ClN2O7
    Molecular Weight
    539.0  g/mol
    InChI Key
    AHHPZGUFLGCZCF-UHFFFAOYSA-N
    FDA UNII
    9QAO5CRP93
    1 2D Structure

    CAS 88150-62-3

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    3-O-ethyl 5-O-methyl 4-(2-chlorophenyl)-2-[2-(1,3-dioxoisoindol-2-yl)ethoxymethyl]-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate
    2.1.2 InChI
    InChI=1S/C28H27ClN2O7/c1-4-38-28(35)24-21(15-37-14-13-31-25(32)17-9-5-6-10-18(17)26(31)33)30-16(2)22(27(34)36-3)23(24)19-11-7-8-12-20(19)29/h5-12,23,30H,4,13-15H2,1-3H3
    2.1.3 InChI Key
    AHHPZGUFLGCZCF-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C(=O)OC)C)COCCN3C(=O)C4=CC=CC=C4C3=O
    2.2 Other Identifiers
    2.2.1 UNII
    9QAO5CRP93
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. Phthaloyl Amlodipine

    2. 88150-62-3

    3. Phthaloylamlodipine

    4. (+/-)-phthalimidoamlodipine

    5. 3-ethyl 5-methyl 4-(2-chlorophenyl)-2-((2-(1,3-dioxoisoindolin-2-yl)ethoxy)methyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate

    6. 9qao5crp93

    7. Amlodipine Related Compound D

    8. Mfcd07782096

    9. 3,5-pyridinedicarboxylic Acid, 4-(2-chlorophenyl)-2-((2-(1,3-dihydro-1,3-dioxo-2h-isoindol-2-yl)ethoxy)methyl)-1,4-dihydro-6-methyl-, 3-ethyl 5-methyl Ester

    10. 3-o-ethyl 5-o-methyl 4-(2-chlorophenyl)-2-[2-(1,3-dioxoisoindol-2-yl)ethoxymethyl]-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate

    11. 3-ethyl 5-methyl (4rs)-4-(2-chlorophenyl)-2-((2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)ethoxy)methyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate

    12. 4-(2-chloroethyl)-3-ethoxycarbonyl-5-methoxycarbonyl-6-methyl-2-((2-phthalimidoethoxy)methyl)-1,4-dihydropyridine

    13. 4-(2-chlorophenyl)-3-(ethoxycarbonyl)-5-(methoxycarbonyl)-6-methyl-2-((2-phthalimidoethoxy)methyl)-1,4-dihydropyridine

    14. 3-ethyl 5-methyl (4rs)-4-(2-chlorophenyl)-2-[[2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)ethoxy]methyl]-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate

    15. Amlodipine Ep Impurity A

    16. Unii-9qao5crp93

    17. Amlodipine Besilate Impurity A

    18. Chembl295696

    19. Schembl3185862

    20. Dtxsid30893841

    21. Bcp13465

    22. Amlodipine Besilate Impurity A [ep]

    23. Akos015895609

    24. Sb64137

    25. 3,5-pyridinedicarboxylic Acid,4-(2-chlorophenyl)-2-[[2-(1,3-dihydro-1,3-dioxo-2h-isoindol-2-yl)ethoxy]methyl]-1,4-dihydro-6-methyl-, 3-ethyl 5-methyl Ester

    26. Ac-19466

    27. As-75270

    28. Sy107510

    29. Cs-0136897

    30. Ft-0658434

    31. P2406

    32. Amlodipine Related Compound D [usp-rs]

    33. Ec 413-410-3

    34. F19238

    35. 150p623

    36. A842484

    37. Amlodipine Besilate Impurity A [ep Impurity]

    38. Q-201577

    39. Q27272892

    40. 3-ethyl 5-methyl 4-(2-chlorophenyl)-1,4-dihydro-2-(2-(1,3-dihydro-1,3-dioxo-(2h)isoindol-2-yl)-ethoxymethyl)-6-methyl-3,5-pyridinedicarboxylate

    41. 3-ethyl 5-methyl 4-(2-chlorophenyl)-2-{[2-(1,3-dioxo-2,3-dihydro-1h-isoindol-2-yl)ethoxy]methyl}-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate

    42. 3-ethyl 5-methyl 4-(2-chlorophenyl)-2-{[2-(1.3-dioxo-1.3-dihydro-2h-isoindol-2-yl) Ethoxy] Methyl}-6-methyl-1.4-dihydro-3.5-pyridine Dicarboxylate

    43. 3-ethyl 5-methyl 4-(2-chlorophenyl)-2-{[2-(1.3-dioxo-1.3-dihydro-2h-isoindol-2-yl) Ethoxy]methyl}-6-methyl-1.4-dihydro-3.5-pyridine Dicarboxylate

    44. 3-ethyl 5-methyl 4-(2-chlorophenyl)-2-{[2-(1.3-dioxo-1.3-dihydro-2h-isoindol-2-yl)ethoxy]methyl}-6-methyl-1.4-dihydro-3.5-pyridine Dicarboxylate

    45. 3-ethyl-5-methyl-4-(2-chlorophenyl)-2-((2-(1,3-dioxoisoindolin-2-yl)ethoxy)methyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate

    46. 4-(2-chlorophenyl)-2-methyl-6-[(2-phthalimidylethoxy)methyl]-1,4-dihydropyridine-3,5-dicarboxylic Acid 3-methyl 5-ethyl Ester

    47. 4-(2-chlorophenyl)-3-ethoxycarbonyl-5-methoxycarbonyl-6-methyl-2-(2-phthalimidoethoxy)methyl-1,4-dihydropyridine

    48. 4-(2-chlorophenyl)-3-ethoxycarbonyl-5-methoxycarbonyl-6-methyl-2-[2-phthalimidoethoxymethyl]-1,4-dihydropyridine

    49. Phthaloyl Amlodipine; Amlodipine Usp Rc D; Phthalimido Amlodipine; 3-ethyl 5-methyl (4rs)-4-(2-chlorophenyl)-2-[[2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)ethoxy]methyl]-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate

    2.4 Create Date
    2006-10-25
    3 Chemical and Physical Properties
    Molecular Weight 539.0 g/mol
    Molecular Formula C28H27ClN2O7
    XLogP34.6
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count8
    Rotatable Bond Count11
    Exact Mass538.1506789 g/mol
    Monoisotopic Mass538.1506789 g/mol
    Topological Polar Surface Area111 Ų
    Heavy Atom Count38
    Formal Charge0
    Complexity999
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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