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Sildenafil Citrate

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SKU: EX1115-50MG Category:
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CID

135413523
CAS

171599-83-0
InChI

InChI=1S/C22H30N6O4S.C6H8O7/c1-5-7-17-19-20(27(4)25-17)22(29)24-21(23-19)16-14-15(8-9-18(16)32-6-2)33(30, 31)28-12-10-26(3)11-13-28;7-3(8)1-6(13, 5(11)12)2-4(9)10/h8-9, 14H, 5-7, 10-13H2, 1-4H3, (H, 23, 24, 29);13H, 1-2H2, (H, 7, 8)(H, 9, 10)(H, 11, 12)
InChIKey

DEIYFTQMQPDXOT-UHFFFAOYSA-N
Canonical SMILES

CCCC1=NN(C2=C1N=C(NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)C)OCC)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O
IUPAC Name

5-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylphenyl]-1-methyl-3-propyl-6H-pyrazolo[4, 3-d]pyrimidin-7-one;2-hydroxypropane-1, 2, 3-tricarboxylic acid
Molecular Formula

C28H38N6O11S
Molecular Weight

666.7
Monoisotopic Mass

666.23192722
Polar Area

250
Complexity

1070
Heavy Atom Count

46
Hydrogen Bond Donor Count

5
Hydrogen Bond Acceptor Count

15
Rotatable Bond Count

12
Physical Appearance

White Opaque Liquid
Stability

Room Temperature

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