3-[4-(3,5-dimethyl-1-adamantyl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;ethyl 6-[4-[3-(2-oxido-4,9-dioxotriazolo[4,5-g]quinolin-2-ium-1-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;methane;3-[4-(6-methoxy-1,3-benzothiazol-2-yl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methyl-3-morpholin-4-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-2-oxido-6-(2-phenylsulfanylethylamino)benzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;1-[3-[4-(4-methyl-3-pyrrolidin-1-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[(4-oxo-5-phenyl-1,3-oxazolidin-2-ylidene)amino]propyl]benzo[f]benzotriazol-2-ium-4,9-dione;2-oxido-1-[3-(4-pyridin-2-ylpiperazin-1-yl)propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazin-1-yl]propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione

C274H297BN66O42S2 — CID 162149320

IUPAC3-[4-(3,5-dimethyl-1-adamantyl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;ethyl 6-[4-[3-(2-oxido-4,9-dioxotriazolo[4,5-g]quinolin-2-ium-1-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;methane;3-[4-(6-methoxy-1,3-benzothiazol-2-yl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methyl-3-morpholin-4-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-2-oxido-6-(2-phenylsulfanylethylamino)benzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;1-[3-[4-(4-methyl-3-pyrrolidin-1-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[(4-oxo-5-phenyl-1,3-oxazolidin-2-ylidene)amino]propyl]benzo[f]benzotriazol-2-ium-4,9-dione;2-oxido-1-[3-(4-pyridin-2-ylpiperazin-1-yl)propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazin-1-yl]propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione
SMILESC.CC1(C)OB(c2ccc(N3CCN(CCCn4c5c(n[n+]4[O-])C(=O)c4cccnc4C5=O)CC3)nc2)OC1(C)C.CC12CC3CC(C)(C1)CC(CCCCn1c4c(n[n+]1[O-])C(=O)c1ccccc1C4=O)(C3)C2.CCOC(=O)c1ccc(N2CCN(CCCn3c4c(n[n+]3[O-])C(=O)c3ncccc3C4=O)CC2)nc1.CN1CCC(N2CCN(CCCn3c4c(n[n+]3[O-])C(=O)c3cccnc3C4=O)CC2)CC1.COc1ccc2nc(CCCCn3c4c(n[n+]3[O-])C(=O)c3ccccc3C4=O)sc2c1.COc1ccccc1N1CCN(CCCn2c3c(n[n+]2[O-])C(=O)c2cccnc2C3=O)CC1.Cc1ccc(N2CCN(CCCn3c4c(n[n+]3[O-])C(=O)c3ccc(NCCSc5ccccc5)cc3C4=O)CC2)cc1.Cc1ccc(N2CCN(CCCn3c4c(n[n+]3[O-])C(=O)c3cccnc3C4=O)CC2)cc1N1CCOCC1.Cc1ccc(N2CCN(CCCn3c4c(n[n+]3[O-])C(=O)c3ncccc3C4=O)CC2)cc1N1CCCC1.O=C1c2ccccc2C(=O)c2c1n[n+]([O-])n2CCC/N=C1\NC(=O)C(c2ccccc2)O1.O=C1c2ncccc2C(=O)c2c1n[n+]([O-])n2CCCN1CCN(c2ccccn2)CC1
InChIInChI=1S/C32H34N6O3S.C27H32BN7O5.C27H31N7O4.C27H31N7O3.C26H31N3O3.C24H25N7O5.C23H24N6O4.C22H29N7O3.C22H17N5O5.C22H18N4O4S.C21H21N7O3.CH4/c1-23-8-11-25(12-9-23)36-19-17-35(18-20-36)15-5-16-37-30-29(34-38(37)41)31(39)27-13-10-24(22-28(27)32(30)40)33-14-21-42-26-6-3-2-4-7-26;1-26(2)27(3,4)40-28(39-26)18-8-9-20(30-17-18)33-15-13-32(14-16-33)11-6-12-34-23-22(31-35(34)38)24(36)19-7-5-10-29-21(19)25(23)37;1-19-5-6-20(18-22(19)32-14-16-38-17-15-32)31-12-10-30(11-13-31)8-3-9-33-25-24(29-34(33)37)26(35)21-4-2-7-28-23(21)27(25)36;1-19-7-8-20(18-22(19)32-11-2-3-12-32)31-16-14-30(15-17-31)10-5-13-33-25-24(29-34(33)37)27(36)23-21(26(25)35)6-4-9-28-23;1-24-11-17-12-25(2,14-24)16-26(13-17,15-24)9-5-6-10-28-21-20(27-29(28)32)22(30)18-7-3-4-8-19(18)23(21)31;1-2-36-24(34)16-6-7-18(26-15-16)29-13-11-28(12-14-29)9-4-10-30-21-20(27-31(30)35)23(33)19-17(22(21)32)5-3-8-25-19;1-33-18-8-3-2-7-17(18)27-14-12-26(13-15-27)10-5-11-28-21-20(25-29(28)32)22(30)16-6-4-9-24-19(16)23(21)31;1-25-10-5-16(6-11-25)27-14-12-26(13-15-27)8-3-9-28-20-19(24-29(28)32)21(30)17-4-2-7-23-18(17)22(20)31;28-18-14-9-4-5-10-15(14)19(29)17-16(18)25-27(31)26(17)12-6-11-23-22-24-21(30)20(32-22)13-7-2-1-3-8-13;1-30-13-9-10-16-17(12-13)31-18(23-16)8-4-5-11-25-20-19(24-26(25)29)21(27)14-6-2-3-7-15(14)22(20)28;29-20-15-5-3-8-23-17(15)21(30)18-19(20)27(28(31)24-18)10-4-9-25-11-13-26(14-12-25)16-6-1-2-7-22-16;/h2-4,6-13,22,33H,5,14-21H2,1H3;5,7-10,17H,6,11-16H2,1-4H3;2,4-7,18H,3,8-17H2,1H3;4,6-9,18H,2-3,5,10-17H2,1H3;3-4,7-8,17H,5-6,9-16H2,1-2H3;3,5-8,15H,2,4,9-14H2,1H3;2-4,6-9H,5,10-15H2,1H3;2,4,7,16H,3,5-6,8-15H2,1H3;1-5,7-10,20H,6,11-12H2,(H,23,24,30);2-3,6-7,9-10,12H,4-5,8,11H2,1H3;1-3,5-8H,4,9-14H2;1H4
InChIKeyZKZDRUJMAMFLSU-UHFFFAOYSA-N
MW5261.76 g/mol
LogP17.88
Rot. Bonds67

About 3-[4-(3,5-dimethyl-1-adamantyl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;ethyl 6-[4-[3-(2-oxido-4,9-dioxotriazolo[4,5-g]quinolin-2-ium-1-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;methane;3-[4-(6-methoxy-1,3-benzothiazol-2-yl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methyl-3-morpholin-4-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-2-oxido-6-(2-phenylsulfanylethylamino)benzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;1-[3-[4-(4-methyl-3-pyrrolidin-1-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[(4-oxo-5-phenyl-1,3-oxazolidin-2-ylidene)amino]propyl]benzo[f]benzotriazol-2-ium-4,9-dione;2-oxido-1-[3-(4-pyridin-2-ylpiperazin-1-yl)propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazin-1-yl]propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione

3-[4-(3,5-dimethyl-1-adamantyl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;ethyl 6-[4-[3-(2-oxido-4,9-dioxotriazolo[4,5-g]quinolin-2-ium-1-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;methane;3-[4-(6-methoxy-1,3-benzothiazol-2-yl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methyl-3-morpholin-4-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-2-oxido-6-(2-phenylsulfanylethylamino)benzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;1-[3-[4-(4-methyl-3-pyrrolidin-1-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[(4-oxo-5-phenyl-1,3-oxazolidin-2-ylidene)amino]propyl]benzo[f]benzotriazol-2-ium-4,9-dione;2-oxido-1-[3-(4-pyridin-2-ylpiperazin-1-yl)propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazin-1-yl]propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione (PubChem CID 162149320) has the molecular formula C274H297BN66O42S2 and a molecular weight of 5261.76 g/mol. Its IUPAC name is 3-[4-(3,5-dimethyl-1-adamantyl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;ethyl 6-[4-[3-(2-oxido-4,9-dioxotriazolo[4,5-g]quinolin-2-ium-1-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;methane;3-[4-(6-methoxy-1,3-benzothiazol-2-yl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methyl-3-morpholin-4-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-2-oxido-6-(2-phenylsulfanylethylamino)benzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;1-[3-[4-(4-methyl-3-pyrrolidin-1-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[(4-oxo-5-phenyl-1,3-oxazolidin-2-ylidene)amino]propyl]benzo[f]benzotriazol-2-ium-4,9-dione;2-oxido-1-[3-(4-pyridin-2-ylpiperazin-1-yl)propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazin-1-yl]propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione.

Molecular Properties

Compound Name3-[4-(3,5-dimethyl-1-adamantyl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;ethyl 6-[4-[3-(2-oxido-4,9-dioxotriazolo[4,5-g]quinolin-2-ium-1-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;methane;3-[4-(6-methoxy-1,3-benzothiazol-2-yl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methyl-3-morpholin-4-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-2-oxido-6-(2-phenylsulfanylethylamino)benzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;1-[3-[4-(4-methyl-3-pyrrolidin-1-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[(4-oxo-5-phenyl-1,3-oxazolidin-2-ylidene)amino]propyl]benzo[f]benzotriazol-2-ium-4,9-dione;2-oxido-1-[3-(4-pyridin-2-ylpiperazin-1-yl)propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazin-1-yl]propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione
PubChem CID162149320
Molecular FormulaC274H297BN66O42S2
Molecular Weight5261.76 g/mol
Exact Mass5258.27
IUPAC Name3-[4-(3,5-dimethyl-1-adamantyl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;ethyl 6-[4-[3-(2-oxido-4,9-dioxotriazolo[4,5-g]quinolin-2-ium-1-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;methane;3-[4-(6-methoxy-1,3-benzothiazol-2-yl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methyl-3-morpholin-4-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-2-oxido-6-(2-phenylsulfanylethylamino)benzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;1-[3-[4-(4-methyl-3-pyrrolidin-1-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[(4-oxo-5-phenyl-1,3-oxazolidin-2-ylidene)amino]propyl]benzo[f]benzotriazol-2-ium-4,9-dione;2-oxido-1-[3-(4-pyridin-2-ylpiperazin-1-yl)propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazin-1-yl]propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione
SMILESC.CC1(C)OB(c2ccc(N3CCN(CCCn4c5c(n[n+]4[O-])C(=O)c4cccnc4C5=O)CC3)nc2)OC1(C)C.CC12CC3CC(C)(C1)CC(CCCCn1c4c(n[n+]1[O-])C(=O)c1ccccc1C4=O)(C3)C2.CCOC(=O)c1ccc(N2CCN(CCCn3c4c(n[n+]3[O-])C(=O)c3ncccc3C4=O)CC2)nc1.CN1CCC(N2CCN(CCCn3c4c(n[n+]3[O-])C(=O)c3cccnc3C4=O)CC2)CC1.COc1ccc2nc(CCCCn3c4c(n[n+]3[O-])C(=O)c3ccccc3C4=O)sc2c1.COc1ccccc1N1CCN(CCCn2c3c(n[n+]2[O-])C(=O)c2cccnc2C3=O)CC1.Cc1ccc(N2CCN(CCCn3c4c(n[n+]3[O-])C(=O)c3ccc(NCCSc5ccccc5)cc3C4=O)CC2)cc1.Cc1ccc(N2CCN(CCCn3c4c(n[n+]3[O-])C(=O)c3cccnc3C4=O)CC2)cc1N1CCOCC1.Cc1ccc(N2CCN(CCCn3c4c(n[n+]3[O-])C(=O)c3ncccc3C4=O)CC2)cc1N1CCCC1.O=C1c2ccccc2C(=O)c2c1n[n+]([O-])n2CCC/N=C1\NC(=O)C(c2ccccc2)O1.O=C1c2ncccc2C(=O)c2c1n[n+]([O-])n2CCCN1CCN(c2ccccn2)CC1
InChIInChI=1S/C32H34N6O3S.C27H32BN7O5.C27H31N7O4.C27H31N7O3.C26H31N3O3.C24H25N7O5.C23H24N6O4.C22H29N7O3.C22H17N5O5.C22H18N4O4S.C21H21N7O3.CH4/c1-23-8-11-25(12-9-23)36-19-17-35(18-20-36)15-5-16-37-30-29(34-38(37)41)31(39)27-13-10-24(22-28(27)32(30)40)33-14-21-42-26-6-3-2-4-7-26;1-26(2)27(3,4)40-28(39-26)18-8-9-20(30-17-18)33-15-13-32(14-16-33)11-6-12-34-23-22(31-35(34)38)24(36)19-7-5-10-29-21(19)25(23)37;1-19-5-6-20(18-22(19)32-14-16-38-17-15-32)31-12-10-30(11-13-31)8-3-9-33-25-24(29-34(33)37)26(35)21-4-2-7-28-23(21)27(25)36;1-19-7-8-20(18-22(19)32-11-2-3-12-32)31-16-14-30(15-17-31)10-5-13-33-25-24(29-34(33)37)27(36)23-21(26(25)35)6-4-9-28-23;1-24-11-17-12-25(2,14-24)16-26(13-17,15-24)9-5-6-10-28-21-20(27-29(28)32)22(30)18-7-3-4-8-19(18)23(21)31;1-2-36-24(34)16-6-7-18(26-15-16)29-13-11-28(12-14-29)9-4-10-30-21-20(27-31(30)35)23(33)19-17(22(21)32)5-3-8-25-19;1-33-18-8-3-2-7-17(18)27-14-12-26(13-15-27)10-5-11-28-21-20(25-29(28)32)22(30)16-6-4-9-24-19(16)23(21)31;1-25-10-5-16(6-11-25)27-14-12-26(13-15-27)8-3-9-28-20-19(24-29(28)32)21(30)17-4-2-7-23-18(17)22(20)31;28-18-14-9-4-5-10-15(14)19(29)17-16(18)25-27(31)26(17)12-6-11-23-22-24-21(30)20(32-22)13-7-2-1-3-8-13;1-30-13-9-10-16-17(12-13)31-18(23-16)8-4-5-11-25-20-19(24-26(25)29)21(27)14-6-2-3-7-15(14)22(20)28;29-20-15-5-3-8-23-17(15)21(30)18-19(20)27(28(31)24-18)10-4-9-25-11-13-26(14-12-25)16-6-1-2-7-22-16;/h2-4,6-13,22,33H,5,14-21H2,1H3;5,7-10,17H,6,11-16H2,1-4H3;2,4-7,18H,3,8-17H2,1H3;4,6-9,18H,2-3,5,10-17H2,1H3;3-4,7-8,17H,5-6,9-16H2,1-2H3;3,5-8,15H,2,4,9-14H2,1H3;2-4,6-9H,5,10-15H2,1H3;2,4,7,16H,3,5-6,8-15H2,1H3;1-5,7-10,20H,6,11-12H2,(H,23,24,30);2-3,6-7,9-10,12H,4-5,8,11H2,1H3;1-3,5-8H,4,9-14H2;1H4
InChIKeyZKZDRUJMAMFLSU-UHFFFAOYSA-N
XLogP17.88
TPSA1206.42 Ų
H-Bond Donors2
H-Bond Acceptors98
Rotatable Bonds67
Heavy Atoms385
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005261.76
LogP ≤ 517.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1098

Analyze 3-[4-(3,5-dimethyl-1-adamantyl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;ethyl 6-[4-[3-(2-oxido-4,9-dioxotriazolo[4,5-g]quinolin-2-ium-1-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;methane;3-[4-(6-methoxy-1,3-benzothiazol-2-yl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methyl-3-morpholin-4-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-2-oxido-6-(2-phenylsulfanylethylamino)benzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;1-[3-[4-(4-methyl-3-pyrrolidin-1-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[(4-oxo-5-phenyl-1,3-oxazolidin-2-ylidene)amino]propyl]benzo[f]benzotriazol-2-ium-4,9-dione;2-oxido-1-[3-(4-pyridin-2-ylpiperazin-1-yl)propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazin-1-yl]propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-[4-(3,5-dimethyl-1-adamantyl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;ethyl 6-[4-[3-(2-oxido-4,9-dioxotriazolo[4,5-g]quinolin-2-ium-1-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;methane;3-[4-(6-methoxy-1,3-benzothiazol-2-yl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methyl-3-morpholin-4-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-2-oxido-6-(2-phenylsulfanylethylamino)benzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;1-[3-[4-(4-methyl-3-pyrrolidin-1-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[(4-oxo-5-phenyl-1,3-oxazolidin-2-ylidene)amino]propyl]benzo[f]benzotriazol-2-ium-4,9-dione;2-oxido-1-[3-(4-pyridin-2-ylpiperazin-1-yl)propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazin-1-yl]propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione?
The IUPAC name of 3-[4-(3,5-dimethyl-1-adamantyl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;ethyl 6-[4-[3-(2-oxido-4,9-dioxotriazolo[4,5-g]quinolin-2-ium-1-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;methane;3-[4-(6-methoxy-1,3-benzothiazol-2-yl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methyl-3-morpholin-4-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-2-oxido-6-(2-phenylsulfanylethylamino)benzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;1-[3-[4-(4-methyl-3-pyrrolidin-1-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[(4-oxo-5-phenyl-1,3-oxazolidin-2-ylidene)amino]propyl]benzo[f]benzotriazol-2-ium-4,9-dione;2-oxido-1-[3-(4-pyridin-2-ylpiperazin-1-yl)propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazin-1-yl]propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione (CID 162149320) is 3-[4-(3,5-dimethyl-1-adamantyl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;ethyl 6-[4-[3-(2-oxido-4,9-dioxotriazolo[4,5-g]quinolin-2-ium-1-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;methane;3-[4-(6-methoxy-1,3-benzothiazol-2-yl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methyl-3-morpholin-4-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-2-oxido-6-(2-phenylsulfanylethylamino)benzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;1-[3-[4-(4-methyl-3-pyrrolidin-1-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[(4-oxo-5-phenyl-1,3-oxazolidin-2-ylidene)amino]propyl]benzo[f]benzotriazol-2-ium-4,9-dione;2-oxido-1-[3-(4-pyridin-2-ylpiperazin-1-yl)propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazin-1-yl]propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione.
What is the SMILES notation for 3-[4-(3,5-dimethyl-1-adamantyl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;ethyl 6-[4-[3-(2-oxido-4,9-dioxotriazolo[4,5-g]quinolin-2-ium-1-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;methane;3-[4-(6-methoxy-1,3-benzothiazol-2-yl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methyl-3-morpholin-4-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-2-oxido-6-(2-phenylsulfanylethylamino)benzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;1-[3-[4-(4-methyl-3-pyrrolidin-1-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[(4-oxo-5-phenyl-1,3-oxazolidin-2-ylidene)amino]propyl]benzo[f]benzotriazol-2-ium-4,9-dione;2-oxido-1-[3-(4-pyridin-2-ylpiperazin-1-yl)propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazin-1-yl]propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione?
The canonical SMILES for 3-[4-(3,5-dimethyl-1-adamantyl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;ethyl 6-[4-[3-(2-oxido-4,9-dioxotriazolo[4,5-g]quinolin-2-ium-1-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;methane;3-[4-(6-methoxy-1,3-benzothiazol-2-yl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methyl-3-morpholin-4-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-2-oxido-6-(2-phenylsulfanylethylamino)benzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;1-[3-[4-(4-methyl-3-pyrrolidin-1-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[(4-oxo-5-phenyl-1,3-oxazolidin-2-ylidene)amino]propyl]benzo[f]benzotriazol-2-ium-4,9-dione;2-oxido-1-[3-(4-pyridin-2-ylpiperazin-1-yl)propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazin-1-yl]propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione is C.CC1(C)OB(c2ccc(N3CCN(CCCn4c5c(n[n+]4[O-])C(=O)c4cccnc4C5=O)CC3)nc2)OC1(C)C.CC12CC3CC(C)(C1)CC(CCCCn1c4c(n[n+]1[O-])C(=O)c1ccccc1C4=O)(C3)C2.CCOC(=O)c1ccc(N2CCN(CCCn3c4c(n[n+]3[O-])C(=O)c3ncccc3C4=O)CC2)nc1.CN1CCC(N2CCN(CCCn3c4c(n[n+]3[O-])C(=O)c3cccnc3C4=O)CC2)CC1.COc1ccc2nc(CCCCn3c4c(n[n+]3[O-])C(=O)c3ccccc3C4=O)sc2c1.COc1ccccc1N1CCN(CCCn2c3c(n[n+]2[O-])C(=O)c2cccnc2C3=O)CC1.Cc1ccc(N2CCN(CCCn3c4c(n[n+]3[O-])C(=O)c3ccc(NCCSc5ccccc5)cc3C4=O)CC2)cc1.Cc1ccc(N2CCN(CCCn3c4c(n[n+]3[O-])C(=O)c3cccnc3C4=O)CC2)cc1N1CCOCC1.Cc1ccc(N2CCN(CCCn3c4c(n[n+]3[O-])C(=O)c3ncccc3C4=O)CC2)cc1N1CCCC1.O=C1c2ccccc2C(=O)c2c1n[n+]([O-])n2CCC/N=C1\NC(=O)C(c2ccccc2)O1.O=C1c2ncccc2C(=O)c2c1n[n+]([O-])n2CCCN1CCN(c2ccccn2)CC1.
What is the InChIKey of 3-[4-(3,5-dimethyl-1-adamantyl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;ethyl 6-[4-[3-(2-oxido-4,9-dioxotriazolo[4,5-g]quinolin-2-ium-1-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;methane;3-[4-(6-methoxy-1,3-benzothiazol-2-yl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methyl-3-morpholin-4-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-2-oxido-6-(2-phenylsulfanylethylamino)benzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;1-[3-[4-(4-methyl-3-pyrrolidin-1-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[(4-oxo-5-phenyl-1,3-oxazolidin-2-ylidene)amino]propyl]benzo[f]benzotriazol-2-ium-4,9-dione;2-oxido-1-[3-(4-pyridin-2-ylpiperazin-1-yl)propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazin-1-yl]propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione?
The InChIKey is ZKZDRUJMAMFLSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H34N6O3S.C27H32BN7O5.C27H31N7O4.C27H31N7O3.C26H31N3O3.C24H25N7O5.C23H24N6O4.C22H29N7O3.C22H17N5O5.C22H18N4O4S.C21H21N7O3.CH4/c1-23-8-11-25(12-9-23)36-19-17-35(18-20-36)15-5-16-37-30-29(34-38(37)41)31(39)27-13-10-24(22-28(27)32(30)40)33-14-21-42-26-6-3-2-4-7-26;1-26(2)27(3,4)40-28(39-26)18-8-9-20(30-17-18)33-15-13-32(14-16-33)11-6-12-34-23-22(31-35(34)38)24(36)19-7-5-10-29-21(19)25(23)37;1-19-5-6-20(18-22(19)32-14-16-38-17-15-32)31-12-10-30(11-13-31)8-3-9-33-25-24(29-34(33)37)26(35)21-4-2-7-28-23(21)27(25)36;1-19-7-8-20(18-22(19)32-11-2-3-12-32)31-16-14-30(15-17-31)10-5-13-33-25-24(29-34(33)37)27(36)23-21(26(25)35)6-4-9-28-23;1-24-11-17-12-25(2,14-24)16-26(13-17,15-24)9-5-6-10-28-21-20(27-29(28)32)22(30)18-7-3-4-8-19(18)23(21)31;1-2-36-24(34)16-6-7-18(26-15-16)29-13-11-28(12-14-29)9-4-10-30-21-20(27-31(30)35)23(33)19-17(22(21)32)5-3-8-25-19;1-33-18-8-3-2-7-17(18)27-14-12-26(13-15-27)10-5-11-28-21-20(25-29(28)32)22(30)16-6-4-9-24-19(16)23(21)31;1-25-10-5-16(6-11-25)27-14-12-26(13-15-27)8-3-9-28-20-19(24-29(28)32)21(30)17-4-2-7-23-18(17)22(20)31;28-18-14-9-4-5-10-15(14)19(29)17-16(18)25-27(31)26(17)12-6-11-23-22-24-21(30)20(32-22)13-7-2-1-3-8-13;1-30-13-9-10-16-17(12-13)31-18(23-16)8-4-5-11-25-20-19(24-26(25)29)21(27)14-6-2-3-7-15(14)22(20)28;29-20-15-5-3-8-23-17(15)21(30)18-19(20)27(28(31)24-18)10-4-9-25-11-13-26(14-12-25)16-6-1-2-7-22-16;/h2-4,6-13,22,33H,5,14-21H2,1H3;5,7-10,17H,6,11-16H2,1-4H3;2,4-7,18H,3,8-17H2,1H3;4,6-9,18H,2-3,5,10-17H2,1H3;3-4,7-8,17H,5-6,9-16H2,1-2H3;3,5-8,15H,2,4,9-14H2,1H3;2-4,6-9H,5,10-15H2,1H3;2,4,7,16H,3,5-6,8-15H2,1H3;1-5,7-10,20H,6,11-12H2,(H,23,24,30);2-3,6-7,9-10,12H,4-5,8,11H2,1H3;1-3,5-8H,4,9-14H2;1H4.
What are the key properties of 3-[4-(3,5-dimethyl-1-adamantyl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;ethyl 6-[4-[3-(2-oxido-4,9-dioxotriazolo[4,5-g]quinolin-2-ium-1-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;methane;3-[4-(6-methoxy-1,3-benzothiazol-2-yl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methyl-3-morpholin-4-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-2-oxido-6-(2-phenylsulfanylethylamino)benzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;1-[3-[4-(4-methyl-3-pyrrolidin-1-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[(4-oxo-5-phenyl-1,3-oxazolidin-2-ylidene)amino]propyl]benzo[f]benzotriazol-2-ium-4,9-dione;2-oxido-1-[3-(4-pyridin-2-ylpiperazin-1-yl)propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazin-1-yl]propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione?
3-[4-(3,5-dimethyl-1-adamantyl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;ethyl 6-[4-[3-(2-oxido-4,9-dioxotriazolo[4,5-g]quinolin-2-ium-1-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;methane;3-[4-(6-methoxy-1,3-benzothiazol-2-yl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methyl-3-morpholin-4-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-2-oxido-6-(2-phenylsulfanylethylamino)benzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;1-[3-[4-(4-methyl-3-pyrrolidin-1-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[(4-oxo-5-phenyl-1,3-oxazolidin-2-ylidene)amino]propyl]benzo[f]benzotriazol-2-ium-4,9-dione;2-oxido-1-[3-(4-pyridin-2-ylpiperazin-1-yl)propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazin-1-yl]propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione has a molecular weight of 5261.76 g/mol, XLogP of 17.88, 67 rotatable bonds, 2 hydrogen bond donors, and 98 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(3,5-dimethyl-1-adamantyl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;ethyl 6-[4-[3-(2-oxido-4,9-dioxotriazolo[4,5-g]quinolin-2-ium-1-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;methane;3-[4-(6-methoxy-1,3-benzothiazol-2-yl)butyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methyl-3-morpholin-4-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;3-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-2-oxido-6-(2-phenylsulfanylethylamino)benzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;1-[3-[4-(4-methyl-3-pyrrolidin-1-ylphenyl)piperazin-1-yl]propyl]-2-oxidotriazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[(4-oxo-5-phenyl-1,3-oxazolidin-2-ylidene)amino]propyl]benzo[f]benzotriazol-2-ium-4,9-dione;2-oxido-1-[3-(4-pyridin-2-ylpiperazin-1-yl)propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione;2-oxido-3-[3-[4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazin-1-yl]propyl]triazolo[4,5-g]quinolin-2-ium-4,9-dione is sourced from PubChem (CID 162149320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).