7-[(2,4-dimethoxyphenyl)methyl]-6,8-dihydroxypyrrolo[3,4-g]quinoline-5,9-dione;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-methoxy-3-pyridinyl)-6H-pyrrolo[3,4-g]quinolin-8-one;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxy-6H-pyrido[4,3-g]quinoline-7,9-dione;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxypyrido[4,3-g]quinolin-9-one;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-oxo-1H-pyridin-3-yl)-6H-pyrrolo[3,4-g]quinolin-8-one;9-hydroxy-5-methoxy-7-[[4-(trifluoromethyl)phenyl]methyl]-6H-pyrrolo[3,4-g]quinolin-8-one

C127H95F7N14O22 — CID 158153675

About 7-[(2,4-dimethoxyphenyl)methyl]-6,8-dihydroxypyrrolo[3,4-g]quinoline-5,9-dione;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-methoxy-3-pyridinyl)-6H-pyrrolo[3,4-g]quinolin-8-one;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxy-6H-pyrido[4,3-g]quinoline-7,9-dione;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxypyrido[4,3-g]quinolin-9-one;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-oxo-1H-pyridin-3-yl)-6H-pyrrolo[3,4-g]quinolin-8-one;9-hydroxy-5-methoxy-7-[[4-(trifluoromethyl)phenyl]methyl]-6H-pyrrolo[3,4-g]quinolin-8-one

7-[(2,4-dimethoxyphenyl)methyl]-6,8-dihydroxypyrrolo[3,4-g]quinoline-5,9-dione;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-methoxy-3-pyridinyl)-6H-pyrrolo[3,4-g]quinolin-8-one;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxy-6H-pyrido[4,3-g]quinoline-7,9-dione;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxypyrido[4,3-g]quinolin-9-one;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-oxo-1H-pyridin-3-yl)-6H-pyrrolo[3,4-g]quinolin-8-one;9-hydroxy-5-methoxy-7-[[4-(trifluoromethyl)phenyl]methyl]-6H-pyrrolo[3,4-g]quinolin-8-one (PubChem CID 158153675) has the molecular formula C127H95F7N14O22 and a molecular weight of 2302.22 g/mol. Its IUPAC name is 7-[(2,4-dimethoxyphenyl)methyl]-6,8-dihydroxypyrrolo[3,4-g]quinoline-5,9-dione;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-methoxy-3-pyridinyl)-6H-pyrrolo[3,4-g]quinolin-8-one;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxy-6H-pyrido[4,3-g]quinoline-7,9-dione;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxypyrido[4,3-g]quinolin-9-one;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-oxo-1H-pyridin-3-yl)-6H-pyrrolo[3,4-g]quinolin-8-one;9-hydroxy-5-methoxy-7-[[4-(trifluoromethyl)phenyl]methyl]-6H-pyrrolo[3,4-g]quinolin-8-one.

Molecular Properties

• Compound Name: 7-[(2,4-dimethoxyphenyl)methyl]-6,8-dihydroxypyrrolo[3,4-g]quinoline-5,9-dione;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-methoxy-3-pyridinyl)-6H-pyrrolo[3,4-g]quinolin-8-one;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxy-6H-pyrido[4,3-g]quinoline-7,9-dione;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxypyrido[4,3-g]quinolin-9-one;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-oxo-1H-pyridin-3-yl)-6H-pyrrolo[3,4-g]quinolin-8-one;9-hydroxy-5-methoxy-7-[[4-(trifluoromethyl)phenyl]methyl]-6H-pyrrolo[3,4-g]quinolin-8-one
• PubChem CID: 158153675
• Molecular Formula: C127H95F7N14O22
• Molecular Weight: 2302.22 g/mol
• Exact Mass: 2300.66
• IUPAC Name: 7-[(2,4-dimethoxyphenyl)methyl]-6,8-dihydroxypyrrolo[3,4-g]quinoline-5,9-dione;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-methoxy-3-pyridinyl)-6H-pyrrolo[3,4-g]quinolin-8-one;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxy-6H-pyrido[4,3-g]quinoline-7,9-dione;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxypyrido[4,3-g]quinolin-9-one;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-oxo-1H-pyridin-3-yl)-6H-pyrrolo[3,4-g]quinolin-8-one;9-hydroxy-5-methoxy-7-[[4-(trifluoromethyl)phenyl]methyl]-6H-pyrrolo[3,4-g]quinolin-8-one
• SMILES: COc1c2c(c(O)c3ncccc13)C(=O)N(Cc1ccc(C(F)(F)F)cc1)C2.COc1c2c(c(O)c3ncccc13)C(=O)N(Cc1ccc(F)cc1)C(=O)C2.COc1c2cccnc2c(O)c2c(=O)n(Cc3ccc(F)cc3)ccc12.COc1ccc(Cn2c(O)c3c(c2O)C(=O)c2ncccc2C3=O)c(OC)c1.COc1ncccc1-c1c2c(c(O)c3ncccc13)C(=O)N(Cc1ccc(F)cc1)C2.O=C1c2c(c(-c3ccc[nH]c3=O)c3cccnc3c2O)CN1Cc1ccc(F)cc1
• InChI: InChI=1S/C24H18FN3O3.C23H16FN3O3.C20H15F3N2O3.C20H15FN2O4.C20H15FN2O3.C20H16N2O6/c1-31-23-17(5-3-11-27-23)19-16-4-2-10-26-21(16)22(29)20-18(19)13-28(24(20)30)12-14-6-8-15(25)9-7-14;24-14-7-5-13(6-8-14)11-27-12-17-18(16-4-2-10-26-22(16)29)15-3-1-9-25-20(15)21(28)19(17)23(27)30;1-28-18-13-3-2-8-24-16(13)17(26)15-14(18)10-25(19(15)27)9-11-4-6-12(7-5-11)20(21,22)23;1-27-19-13-3-2-8-22-17(13)18(25)16-14(19)9-15(24)23(20(16)26)10-11-4-6-12(21)7-5-11;1-26-19-14-8-10-23(11-12-4-6-13(21)7-5-12)20(25)16(14)18(24)17-15(19)3-2-9-22-17;1-27-11-6-5-10(13(8-11)28-2)9-22-19(25)14-15(20(22)26)18(24)16-12(17(14)23)4-3-7-21-16/h2-11,29H,12-13H2,1H3;1-10,28H,11-12H2,(H,26,29);2-8,26H,9-10H2,1H3;2-8,25H,9-10H2,1H3;2-10,24H,11H2,1H3;3-8,25-26H,9H2,1-2H3
• InChIKey: RGVFVUMWSDMCPK-UHFFFAOYSA-N
• XLogP: 20.42
• TPSA: 479.46 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 31
• Rotatable Bonds: 20
• Heavy Atoms: 170
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2302.22
LogP ≤ 5	20.42
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'quinone_A(370)', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 7-[(2,4-dimethoxyphenyl)methyl]-6,8-dihydroxypyrrolo[3,4-g]quinoline-5,9-dione;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-methoxy-3-pyridinyl)-6H-pyrrolo[3,4-g]quinolin-8-one;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxy-6H-pyrido[4,3-g]quinoline-7,9-dione;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxypyrido[4,3-g]quinolin-9-one;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-oxo-1H-pyridin-3-yl)-6H-pyrrolo[3,4-g]quinolin-8-one;9-hydroxy-5-methoxy-7-[[4-(trifluoromethyl)phenyl]methyl]-6H-pyrrolo[3,4-g]quinolin-8-one?

The IUPAC name of 7-[(2,4-dimethoxyphenyl)methyl]-6,8-dihydroxypyrrolo[3,4-g]quinoline-5,9-dione;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-methoxy-3-pyridinyl)-6H-pyrrolo[3,4-g]quinolin-8-one;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxy-6H-pyrido[4,3-g]quinoline-7,9-dione;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxypyrido[4,3-g]quinolin-9-one;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-oxo-1H-pyridin-3-yl)-6H-pyrrolo[3,4-g]quinolin-8-one;9-hydroxy-5-methoxy-7-[[4-(trifluoromethyl)phenyl]methyl]-6H-pyrrolo[3,4-g]quinolin-8-one (CID 158153675) is 7-[(2,4-dimethoxyphenyl)methyl]-6,8-dihydroxypyrrolo[3,4-g]quinoline-5,9-dione;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-methoxy-3-pyridinyl)-6H-pyrrolo[3,4-g]quinolin-8-one;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxy-6H-pyrido[4,3-g]quinoline-7,9-dione;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxypyrido[4,3-g]quinolin-9-one;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-oxo-1H-pyridin-3-yl)-6H-pyrrolo[3,4-g]quinolin-8-one;9-hydroxy-5-methoxy-7-[[4-(trifluoromethyl)phenyl]methyl]-6H-pyrrolo[3,4-g]quinolin-8-one.

What is the SMILES notation for 7-[(2,4-dimethoxyphenyl)methyl]-6,8-dihydroxypyrrolo[3,4-g]quinoline-5,9-dione;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-methoxy-3-pyridinyl)-6H-pyrrolo[3,4-g]quinolin-8-one;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxy-6H-pyrido[4,3-g]quinoline-7,9-dione;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxypyrido[4,3-g]quinolin-9-one;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-oxo-1H-pyridin-3-yl)-6H-pyrrolo[3,4-g]quinolin-8-one;9-hydroxy-5-methoxy-7-[[4-(trifluoromethyl)phenyl]methyl]-6H-pyrrolo[3,4-g]quinolin-8-one?

The canonical SMILES for 7-[(2,4-dimethoxyphenyl)methyl]-6,8-dihydroxypyrrolo[3,4-g]quinoline-5,9-dione;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-methoxy-3-pyridinyl)-6H-pyrrolo[3,4-g]quinolin-8-one;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxy-6H-pyrido[4,3-g]quinoline-7,9-dione;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxypyrido[4,3-g]quinolin-9-one;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-oxo-1H-pyridin-3-yl)-6H-pyrrolo[3,4-g]quinolin-8-one;9-hydroxy-5-methoxy-7-[[4-(trifluoromethyl)phenyl]methyl]-6H-pyrrolo[3,4-g]quinolin-8-one is COc1c2c(c(O)c3ncccc13)C(=O)N(Cc1ccc(C(F)(F)F)cc1)C2.COc1c2c(c(O)c3ncccc13)C(=O)N(Cc1ccc(F)cc1)C(=O)C2.COc1c2cccnc2c(O)c2c(=O)n(Cc3ccc(F)cc3)ccc12.COc1ccc(Cn2c(O)c3c(c2O)C(=O)c2ncccc2C3=O)c(OC)c1.COc1ncccc1-c1c2c(c(O)c3ncccc13)C(=O)N(Cc1ccc(F)cc1)C2.O=C1c2c(c(-c3ccc[nH]c3=O)c3cccnc3c2O)CN1Cc1ccc(F)cc1.

What is the InChIKey of 7-[(2,4-dimethoxyphenyl)methyl]-6,8-dihydroxypyrrolo[3,4-g]quinoline-5,9-dione;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-methoxy-3-pyridinyl)-6H-pyrrolo[3,4-g]quinolin-8-one;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxy-6H-pyrido[4,3-g]quinoline-7,9-dione;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxypyrido[4,3-g]quinolin-9-one;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-oxo-1H-pyridin-3-yl)-6H-pyrrolo[3,4-g]quinolin-8-one;9-hydroxy-5-methoxy-7-[[4-(trifluoromethyl)phenyl]methyl]-6H-pyrrolo[3,4-g]quinolin-8-one?

The InChIKey is RGVFVUMWSDMCPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18FN3O3.C23H16FN3O3.C20H15F3N2O3.C20H15FN2O4.C20H15FN2O3.C20H16N2O6/c1-31-23-17(5-3-11-27-23)19-16-4-2-10-26-21(16)22(29)20-18(19)13-28(24(20)30)12-14-6-8-15(25)9-7-14;24-14-7-5-13(6-8-14)11-27-12-17-18(16-4-2-10-26-22(16)29)15-3-1-9-25-20(15)21(28)19(17)23(27)30;1-28-18-13-3-2-8-24-16(13)17(26)15-14(18)10-25(19(15)27)9-11-4-6-12(7-5-11)20(21,22)23;1-27-19-13-3-2-8-22-17(13)18(25)16-14(19)9-15(24)23(20(16)26)10-11-4-6-12(21)7-5-11;1-26-19-14-8-10-23(11-12-4-6-13(21)7-5-12)20(25)16(14)18(24)17-15(19)3-2-9-22-17;1-27-11-6-5-10(13(8-11)28-2)9-22-19(25)14-15(20(22)26)18(24)16-12(17(14)23)4-3-7-21-16/h2-11,29H,12-13H2,1H3;1-10,28H,11-12H2,(H,26,29);2-8,26H,9-10H2,1H3;2-8,25H,9-10H2,1H3;2-10,24H,11H2,1H3;3-8,25-26H,9H2,1-2H3.

What are the key properties of 7-[(2,4-dimethoxyphenyl)methyl]-6,8-dihydroxypyrrolo[3,4-g]quinoline-5,9-dione;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-methoxy-3-pyridinyl)-6H-pyrrolo[3,4-g]quinolin-8-one;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxy-6H-pyrido[4,3-g]quinoline-7,9-dione;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxypyrido[4,3-g]quinolin-9-one;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-oxo-1H-pyridin-3-yl)-6H-pyrrolo[3,4-g]quinolin-8-one;9-hydroxy-5-methoxy-7-[[4-(trifluoromethyl)phenyl]methyl]-6H-pyrrolo[3,4-g]quinolin-8-one?

7-[(2,4-dimethoxyphenyl)methyl]-6,8-dihydroxypyrrolo[3,4-g]quinoline-5,9-dione;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-methoxy-3-pyridinyl)-6H-pyrrolo[3,4-g]quinolin-8-one;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxy-6H-pyrido[4,3-g]quinoline-7,9-dione;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxypyrido[4,3-g]quinolin-9-one;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-oxo-1H-pyridin-3-yl)-6H-pyrrolo[3,4-g]quinolin-8-one;9-hydroxy-5-methoxy-7-[[4-(trifluoromethyl)phenyl]methyl]-6H-pyrrolo[3,4-g]quinolin-8-one has a molecular weight of 2302.22 g/mol, XLogP of 20.42, 20 rotatable bonds, 8 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 7-[(2,4-dimethoxyphenyl)methyl]-6,8-dihydroxypyrrolo[3,4-g]quinoline-5,9-dione;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-methoxy-3-pyridinyl)-6H-pyrrolo[3,4-g]quinolin-8-one;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxy-6H-pyrido[4,3-g]quinoline-7,9-dione;8-[(4-fluorophenyl)methyl]-10-hydroxy-5-methoxypyrido[4,3-g]quinolin-9-one;7-[(4-fluorophenyl)methyl]-9-hydroxy-5-(2-oxo-1H-pyridin-3-yl)-6H-pyrrolo[3,4-g]quinolin-8-one;9-hydroxy-5-methoxy-7-[[4-(trifluoromethyl)phenyl]methyl]-6H-pyrrolo[3,4-g]quinolin-8-one is sourced from PubChem (CID 158153675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).