Lodenafil Carbonate
bis[2-[4-[4-ethoxy-3-(1-methyl-7-oxo-3-propyl-6H-pyrazolo[4,5-d]pyrimidin-5-yl)phenyl]sulfonylpiperazin-1-yl]ethyl] carbonate
Molecular Identity
Lodenafil Carbonate
bis[2-[4-[4-ethoxy-3-(1-methyl-7-oxo-3-propyl-6H-pyrazolo[4,5-d]pyrimidin-5-yl)phenyl]sulfonylpiperazin-1-yl]ethyl] carbonate
PubChem CID: 135431100
2D Structure
Properties
C47H62N12O11S2
Molecular Formula
1035.20
Molecular Weight
g/mol
1034.4102
Exact Mass
Da
3
XLogP
Drug-like (Lipinski: < 5)
271
TPSA
May have limited oral absorption
2
H-Bond Donors
19
H-Bond Acceptors
2020
Complexity
SMILES
Canonical SMILES
SMILES: CCCC1=NN(C2=C1N=C(NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)CCOC(=O)OCCN5CCN(CC5)S(=O)(=O)C6=CC(=C(C=C6)OCC)C7=NC8=C(C(=O)N7)N(N=C8CCC)C)OCC)CIsomeric SMILES
SMILES: CCCC1=NN(C2=C1N=C(NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)CCOC(=O)OCCN5CCN(CC5)S(=O)(=O)C6=CC(=C(C=C6)OCC)C7=NC8=C(C(=O)N7)N(N=C8CCC)C)OCC)CSynonyms(20)
Lodenafil carbonate398507-55-6Hellevacarbonato de lodenafilo29X84F932DDTXSID70192906bis-(2-(4-(4-ethoxy-3-(1-methyl-7-oxo-3-propyl-6,7-dihydro-1h-pyrazolo(4,3-d)pyrimidin-5-yl)-benzenesulfonyl)piperazin-1-yl)-ethyl)carbonatelodenafili carbonasRefChem:153933DTXCID70115397bis(2-(4-(4-ethoxy-3-(1-methyl-7-oxo-3-propyl-1H,6H,7H-pyrazolo(4,3-d)pyrimidin-5-yl)benzenesulfonyl)piperazin-1-yl)ethyl) carbonateLodenafil carbonate [INN]LodenafilcarbonateUNII-29X84F932D7H-Pyrazolo[4,3-d]pyrimidin-7-one, 5,5'-[carbonylbis[oxy-2,1-ethanediyl-4,1-piperazinediylsulfonyl(6-ethoxy-3,1-phenylene)]]bis[1,6-dihydro-1-methyl-3-propyl-; 1-Piperazineethanol, 4-[[3-(4,7-dihydro-1-methyl-7-oxo-3-propyl-1H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-ethoxyphenyl]sulfonyl]-, carbonate (2:1) (ester) (9CI); Lodenafil carbonate
Data from PubChem (NCBI)
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