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    Technical details about Mirodenafil dihydrochloride, learn more about the structure, uses, toxicity, action, side effects and more

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    Mirodenafil dihydrochloride

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    2D Structure
    1. Also known as: 862189-96-6, Mirodenafil (dihydrochloride), Nl7l8twt8y, Mirodenafil hydrochloride, Unii-nl7l8twt8y, Mvix
    Molecular Formula
    C26H39Cl2N5O5S
    Molecular Weight
    604.6  g/mol
    InChI Key
    CKPHITUXXABKDL-UHFFFAOYSA-N
    FDA UNII
    NL7L8TWT8Y
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    5-ethyl-2-[5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-2-propoxyphenyl]-7-propyl-3H-pyrrolo[3,2-d]pyrimidin-4-one;dihydrochloride
    2.1.2 InChI
    InChI=1S/C26H37N5O5S.2ClH/c1-4-7-19-18-30(6-3)24-23(19)27-25(28-26(24)33)21-17-20(8-9-22(21)36-16-5-2)37(34,35)31-12-10-29(11-13-31)14-15-32;;/h8-9,17-18,32H,4-7,10-16H2,1-3H3,(H,27,28,33);2*1H
    2.1.3 InChI Key
    CKPHITUXXABKDL-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCCC1=CN(C2=C1N=C(NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)CCO)OCCC)CC.Cl.Cl
    2.2 Other Identifiers
    2.2.1 UNII
    NL7L8TWT8Y
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 862189-96-6

    2. Mirodenafil (dihydrochloride)

    3. Nl7l8twt8y

    4. Mirodenafil Hydrochloride

    5. Unii-nl7l8twt8y

    6. Mvix

    7. Sk 3530

    8. 862189-96-6 (hcl)

    9. Sk-3530

    10. 5-ethyl-2-[5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-2-propoxyphenyl]-7-propyl-3h-pyrrolo[3,2-d]pyrimidin-4-one;dihydrochloride

    11. 5-ethyl-2-(5-((4-(2-hydroxyethyl)piperazin-1-yl)sulfonyl)-2-propoxyphenyl)-7-propyl-3,5-dihydro-4h-pyrrolo[3,2-d]pyrimidin-4-one Dihydrochloride

    12. 5-ethyl-2-(5-(4-(2-hydroxyethyl)piperazine-1-sulfonyl)-2-propoxyphenyl)-7-propyl-3,5-dihydropyrrolo(3,2-d)pyrimidin-4-one

    13. 5-ethyl-2-(5-{[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl}-2-propoxyphenyl)-7-propyl-3h,4h,5h-pyrrolo[3,2-d]pyrimidin-4-one Dihydrochloride

    14. 5-ethyl-2-[5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-2-propoxyphenyl]-7-propyl-1h-pyrrolo[3,2-d]pyrimidin-4-one Dihydrochloride

    15. Sk-3530 Dihydrochloride

    16. M-vix

    17. Schembl22028340

    18. Hy-14930a

    19. Cs-3125

    20. Mirodenafil Hydrochloride [who-dd]

    21. Ms-30654

    22. F85032

    23. Sk-3530 Dihydrochloridesk-3530 Dihydrochloride

    24. A914997

    25. 1-piperazineethanol, 4-((3-(5-ethyl-4,5-dihydro-4-oxo-7-propyl-1h-pyrrolo(3,2-d)pyrimidin-2-yl)-4-propoxyphenyl)sulfonyl)-, Dihydrochloride

    26. 4h-pyrrolo(3,2-d)pyrimidin-4-one, 5-ethyl-3,5-dihydro-2-(5-((4-(2-hydroxyethyl)-1-piperazinyl)sulfonyl)-2-propoxyphenyl)-7-propyl-, Hydrochloride (1:2)

    27. 5-ethyl-2-(5-{[4-(2-hydroxyethyl)-1-piperazinyl]sulfonyl}-2-propo Xyphenyl)-7-propyl-3,5-dihydro-4h-pyrrolo[3,2-d]pyrimidin-4-one D Ihydrochloride

    28. 5-ethyl-3,5-dihydro-2-(5-((4-(2-hydroxyethyl)-1-piperazinyl)sulfonyl)-2-propoxyphenyl)-7-propyl-4h-pyrrolo(3,2-d)pyrimidin-4-one Hydrochloride (1:2)

    2.4 Create Date
    2019-01-15
    3 Chemical and Physical Properties
    Molecular Weight 604.6 g/mol
    Molecular Formula C26H39Cl2N5O5S
    Hydrogen Bond Donor Count4
    Hydrogen Bond Acceptor Count8
    Rotatable Bond Count11
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area125
    Heavy Atom Count39
    Formal Charge0
    Complexity902
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count3
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