10-[[4-[[2-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-3H-indol-1-ium-2-yl]methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;10-[[4-[[4-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-2,3,6-trimethylpyridin-1-ium-4-yl]methyl]-2,3,6-trimethylpyridin-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;ethane;(Z)-1-methyl-N-[(E)-[1-[[4-[[2,3,6-trimethyl-4-[[2,3,6-trimethyl-1-[[4-[[(2Z)-2-[(Z)-(1-methyl-3H-indol-2-ylidene)hydrazinylidene]-3H-indol-1-yl]methyl]phenyl]methyl]pyridin-1-ium-4-yl]methyl]pyridin-1-ium-1-yl]methyl]phenyl]methyl]-3H-indol-2-ylidene]amino]-3H-indol-2-imine

C205H228N18+6 — CID 172962120

About 10-[[4-[[2-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-3H-indol-1-ium-2-yl]methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;10-[[4-[[4-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-2,3,6-trimethylpyridin-1-ium-4-yl]methyl]-2,3,6-trimethylpyridin-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;ethane;(Z)-1-methyl-N-[(E)-[1-[[4-[[2,3,6-trimethyl-4-[[2,3,6-trimethyl-1-[[4-[[(2Z)-2-[(Z)-(1-methyl-3H-indol-2-ylidene)hydrazinylidene]-3H-indol-1-yl]methyl]phenyl]methyl]pyridin-1-ium-4-yl]methyl]pyridin-1-ium-1-yl]methyl]phenyl]methyl]-3H-indol-2-ylidene]amino]-3H-indol-2-imine

10-[[4-[[2-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-3H-indol-1-ium-2-yl]methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;10-[[4-[[4-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-2,3,6-trimethylpyridin-1-ium-4-yl]methyl]-2,3,6-trimethylpyridin-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;ethane;(Z)-1-methyl-N-[(E)-[1-[[4-[[2,3,6-trimethyl-4-[[2,3,6-trimethyl-1-[[4-[[(2Z)-2-[(Z)-(1-methyl-3H-indol-2-ylidene)hydrazinylidene]-3H-indol-1-yl]methyl]phenyl]methyl]pyridin-1-ium-4-yl]methyl]pyridin-1-ium-1-yl]methyl]phenyl]methyl]-3H-indol-2-ylidene]amino]-3H-indol-2-imine (PubChem CID 172962120) has the molecular formula C205H228N18+6 and a molecular weight of 2944.20 g/mol. Its IUPAC name is 10-[[4-[[2-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-3H-indol-1-ium-2-yl]methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;10-[[4-[[4-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-2,3,6-trimethylpyridin-1-ium-4-yl]methyl]-2,3,6-trimethylpyridin-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;ethane;(Z)-1-methyl-N-[(E)-[1-[[4-[[2,3,6-trimethyl-4-[[2,3,6-trimethyl-1-[[4-[[(2Z)-2-[(Z)-(1-methyl-3H-indol-2-ylidene)hydrazinylidene]-3H-indol-1-yl]methyl]phenyl]methyl]pyridin-1-ium-4-yl]methyl]pyridin-1-ium-1-yl]methyl]phenyl]methyl]-3H-indol-2-ylidene]amino]-3H-indol-2-imine.

Molecular Properties

• Compound Name: 10-[[4-[[2-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-3H-indol-1-ium-2-yl]methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;10-[[4-[[4-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-2,3,6-trimethylpyridin-1-ium-4-yl]methyl]-2,3,6-trimethylpyridin-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;ethane;(Z)-1-methyl-N-[(E)-[1-[[4-[[2,3,6-trimethyl-4-[[2,3,6-trimethyl-1-[[4-[[(2Z)-2-[(Z)-(1-methyl-3H-indol-2-ylidene)hydrazinylidene]-3H-indol-1-yl]methyl]phenyl]methyl]pyridin-1-ium-4-yl]methyl]pyridin-1-ium-1-yl]methyl]phenyl]methyl]-3H-indol-2-ylidene]amino]-3H-indol-2-imine
• PubChem CID: 172962120
• Molecular Formula: C205H228N18+6
• Molecular Weight: 2944.20 g/mol
• Exact Mass: 2941.84
• IUPAC Name: 10-[[4-[[2-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-3H-indol-1-ium-2-yl]methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;10-[[4-[[4-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-2,3,6-trimethylpyridin-1-ium-4-yl]methyl]-2,3,6-trimethylpyridin-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;ethane;(Z)-1-methyl-N-[(E)-[1-[[4-[[2,3,6-trimethyl-4-[[2,3,6-trimethyl-1-[[4-[[(2Z)-2-[(Z)-(1-methyl-3H-indol-2-ylidene)hydrazinylidene]-3H-indol-1-yl]methyl]phenyl]methyl]pyridin-1-ium-4-yl]methyl]pyridin-1-ium-1-yl]methyl]phenyl]methyl]-3H-indol-2-ylidene]amino]-3H-indol-2-imine
• SMILES: CC.CC.CC.CC.CC.CC.Cc1c(Cc2cc(C)[n+](Cc3ccc(CN4/C(=N/N=C5/Cc6ccccc6N5C)Cc5ccccc54)cc3)c(C)c2C)cc(C)[n+](Cc2ccc(CN3/C(=N\N=C4\Cc5ccccc5N4C)Cc4ccccc43)cc2)c1C.Cc1ccc2c(c1)Cc1cc(C)ccc1N2Cc1ccc(C[N+]2=C(CC3=[N+](Cc4ccc(CN5c6ccc(C)cc6Cc6cc(C)ccc65)cc4)c4ccccc4C3)Cc3ccccc32)cc1.Cc1ccc2c(c1)Cc1cc(C)ccc1N2Cc1ccc(C[n+]2c(C)cc(Cc3cc(C)[n+](Cc4ccc(CN5c6ccc(C)cc6Cc6cc(C)ccc65)cc4)c(C)c3C)c(C)c2C)cc1
• InChI: InChI=1S/C67H68N10.C63H58N4.C63H66N4.6C2H6/c1-44-33-58(46(3)48(5)74(44)40-50-25-29-52(30-26-50)42-76-62-23-15-11-19-56(62)38-66(76)70-68-64-36-54-17-9-13-21-60(54)72(64)7)35-59-34-45(2)75(49(6)47(59)4)41-51-27-31-53(32-28-51)43-77-63-24-16-12-20-57(63)39-67(77)71-69-65-37-55-18-10-14-22-61(55)73(65)8;1-42-13-25-60-52(29-42)33-53-30-43(2)14-26-61(53)66(60)40-48-21-17-46(18-22-48)38-64-56(35-50-9-5-7-11-58(50)64)37-57-36-51-10-6-8-12-59(51)65(57)39-47-19-23-49(24-20-47)41-67-62-27-15-44(3)31-54(62)34-55-32-45(4)16-28-63(55)67;1-40-11-23-60-56(27-40)34-57-28-41(2)12-24-61(57)66(60)38-52-19-15-50(16-20-52)36-64-44(5)31-54(46(7)48(64)9)33-55-32-45(6)65(49(10)47(55)8)37-51-17-21-53(22-18-51)39-67-62-25-13-42(3)29-58(62)35-59-30-43(4)14-26-63(59)67;6*1-2/h9-34H,35-43H2,1-8H3;5-32H,33-41H2,1-4H3;11-32H,33-39H2,1-10H3;6*1-2H3/q3*+2;;;;;;/b68-64-,69-65-,70-66-,71-67+
• InChIKey: AYNOFIWJXWBBGA-ZVEQICDBSA-N
• XLogP: 45.59
• TPSA: 96.90 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 32
• Heavy Atoms: 223
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2944.20
LogP ≤ 5	45.59
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 10-[[4-[[2-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-3H-indol-1-ium-2-yl]methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;10-[[4-[[4-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-2,3,6-trimethylpyridin-1-ium-4-yl]methyl]-2,3,6-trimethylpyridin-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;ethane;(Z)-1-methyl-N-[(E)-[1-[[4-[[2,3,6-trimethyl-4-[[2,3,6-trimethyl-1-[[4-[[(2Z)-2-[(Z)-(1-methyl-3H-indol-2-ylidene)hydrazinylidene]-3H-indol-1-yl]methyl]phenyl]methyl]pyridin-1-ium-4-yl]methyl]pyridin-1-ium-1-yl]methyl]phenyl]methyl]-3H-indol-2-ylidene]amino]-3H-indol-2-imine?

The IUPAC name of 10-[[4-[[2-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-3H-indol-1-ium-2-yl]methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;10-[[4-[[4-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-2,3,6-trimethylpyridin-1-ium-4-yl]methyl]-2,3,6-trimethylpyridin-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;ethane;(Z)-1-methyl-N-[(E)-[1-[[4-[[2,3,6-trimethyl-4-[[2,3,6-trimethyl-1-[[4-[[(2Z)-2-[(Z)-(1-methyl-3H-indol-2-ylidene)hydrazinylidene]-3H-indol-1-yl]methyl]phenyl]methyl]pyridin-1-ium-4-yl]methyl]pyridin-1-ium-1-yl]methyl]phenyl]methyl]-3H-indol-2-ylidene]amino]-3H-indol-2-imine (CID 172962120) is 10-[[4-[[2-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-3H-indol-1-ium-2-yl]methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;10-[[4-[[4-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-2,3,6-trimethylpyridin-1-ium-4-yl]methyl]-2,3,6-trimethylpyridin-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;ethane;(Z)-1-methyl-N-[(E)-[1-[[4-[[2,3,6-trimethyl-4-[[2,3,6-trimethyl-1-[[4-[[(2Z)-2-[(Z)-(1-methyl-3H-indol-2-ylidene)hydrazinylidene]-3H-indol-1-yl]methyl]phenyl]methyl]pyridin-1-ium-4-yl]methyl]pyridin-1-ium-1-yl]methyl]phenyl]methyl]-3H-indol-2-ylidene]amino]-3H-indol-2-imine.

What is the SMILES notation for 10-[[4-[[2-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-3H-indol-1-ium-2-yl]methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;10-[[4-[[4-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-2,3,6-trimethylpyridin-1-ium-4-yl]methyl]-2,3,6-trimethylpyridin-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;ethane;(Z)-1-methyl-N-[(E)-[1-[[4-[[2,3,6-trimethyl-4-[[2,3,6-trimethyl-1-[[4-[[(2Z)-2-[(Z)-(1-methyl-3H-indol-2-ylidene)hydrazinylidene]-3H-indol-1-yl]methyl]phenyl]methyl]pyridin-1-ium-4-yl]methyl]pyridin-1-ium-1-yl]methyl]phenyl]methyl]-3H-indol-2-ylidene]amino]-3H-indol-2-imine?

The canonical SMILES for 10-[[4-[[2-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-3H-indol-1-ium-2-yl]methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;10-[[4-[[4-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-2,3,6-trimethylpyridin-1-ium-4-yl]methyl]-2,3,6-trimethylpyridin-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;ethane;(Z)-1-methyl-N-[(E)-[1-[[4-[[2,3,6-trimethyl-4-[[2,3,6-trimethyl-1-[[4-[[(2Z)-2-[(Z)-(1-methyl-3H-indol-2-ylidene)hydrazinylidene]-3H-indol-1-yl]methyl]phenyl]methyl]pyridin-1-ium-4-yl]methyl]pyridin-1-ium-1-yl]methyl]phenyl]methyl]-3H-indol-2-ylidene]amino]-3H-indol-2-imine is CC.CC.CC.CC.CC.CC.Cc1c(Cc2cc(C)[n+](Cc3ccc(CN4/C(=N/N=C5/Cc6ccccc6N5C)Cc5ccccc54)cc3)c(C)c2C)cc(C)[n+](Cc2ccc(CN3/C(=N\N=C4\Cc5ccccc5N4C)Cc4ccccc43)cc2)c1C.Cc1ccc2c(c1)Cc1cc(C)ccc1N2Cc1ccc(C[N+]2=C(CC3=[N+](Cc4ccc(CN5c6ccc(C)cc6Cc6cc(C)ccc65)cc4)c4ccccc4C3)Cc3ccccc32)cc1.Cc1ccc2c(c1)Cc1cc(C)ccc1N2Cc1ccc(C[n+]2c(C)cc(Cc3cc(C)[n+](Cc4ccc(CN5c6ccc(C)cc6Cc6cc(C)ccc65)cc4)c(C)c3C)c(C)c2C)cc1.

What is the InChIKey of 10-[[4-[[2-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-3H-indol-1-ium-2-yl]methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;10-[[4-[[4-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-2,3,6-trimethylpyridin-1-ium-4-yl]methyl]-2,3,6-trimethylpyridin-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;ethane;(Z)-1-methyl-N-[(E)-[1-[[4-[[2,3,6-trimethyl-4-[[2,3,6-trimethyl-1-[[4-[[(2Z)-2-[(Z)-(1-methyl-3H-indol-2-ylidene)hydrazinylidene]-3H-indol-1-yl]methyl]phenyl]methyl]pyridin-1-ium-4-yl]methyl]pyridin-1-ium-1-yl]methyl]phenyl]methyl]-3H-indol-2-ylidene]amino]-3H-indol-2-imine?

The InChIKey is AYNOFIWJXWBBGA-ZVEQICDBSA-N. The full InChI is InChI=1S/C67H68N10.C63H58N4.C63H66N4.6C2H6/c1-44-33-58(46(3)48(5)74(44)40-50-25-29-52(30-26-50)42-76-62-23-15-11-19-56(62)38-66(76)70-68-64-36-54-17-9-13-21-60(54)72(64)7)35-59-34-45(2)75(49(6)47(59)4)41-51-27-31-53(32-28-51)43-77-63-24-16-12-20-57(63)39-67(77)71-69-65-37-55-18-10-14-22-61(55)73(65)8;1-42-13-25-60-52(29-42)33-53-30-43(2)14-26-61(53)66(60)40-48-21-17-46(18-22-48)38-64-56(35-50-9-5-7-11-58(50)64)37-57-36-51-10-6-8-12-59(51)65(57)39-47-19-23-49(24-20-47)41-67-62-27-15-44(3)31-54(62)34-55-32-45(4)16-28-63(55)67;1-40-11-23-60-56(27-40)34-57-28-41(2)12-24-61(57)66(60)38-52-19-15-50(16-20-52)36-64-44(5)31-54(46(7)48(64)9)33-55-32-45(6)65(49(10)47(55)8)37-51-17-21-53(22-18-51)39-67-62-25-13-42(3)29-58(62)35-59-30-43(4)14-26-63(59)67;6*1-2/h9-34H,35-43H2,1-8H3;5-32H,33-41H2,1-4H3;11-32H,33-39H2,1-10H3;6*1-2H3/q3*+2;;;;;;/b68-64-,69-65-,70-66-,71-67+;;;;;;;;.

What are the key properties of 10-[[4-[[2-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-3H-indol-1-ium-2-yl]methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;10-[[4-[[4-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-2,3,6-trimethylpyridin-1-ium-4-yl]methyl]-2,3,6-trimethylpyridin-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;ethane;(Z)-1-methyl-N-[(E)-[1-[[4-[[2,3,6-trimethyl-4-[[2,3,6-trimethyl-1-[[4-[[(2Z)-2-[(Z)-(1-methyl-3H-indol-2-ylidene)hydrazinylidene]-3H-indol-1-yl]methyl]phenyl]methyl]pyridin-1-ium-4-yl]methyl]pyridin-1-ium-1-yl]methyl]phenyl]methyl]-3H-indol-2-ylidene]amino]-3H-indol-2-imine?

10-[[4-[[2-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-3H-indol-1-ium-2-yl]methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;10-[[4-[[4-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-2,3,6-trimethylpyridin-1-ium-4-yl]methyl]-2,3,6-trimethylpyridin-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;ethane;(Z)-1-methyl-N-[(E)-[1-[[4-[[2,3,6-trimethyl-4-[[2,3,6-trimethyl-1-[[4-[[(2Z)-2-[(Z)-(1-methyl-3H-indol-2-ylidene)hydrazinylidene]-3H-indol-1-yl]methyl]phenyl]methyl]pyridin-1-ium-4-yl]methyl]pyridin-1-ium-1-yl]methyl]phenyl]methyl]-3H-indol-2-ylidene]amino]-3H-indol-2-imine has a molecular weight of 2944.20 g/mol, XLogP of 45.59, 32 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 10-[[4-[[2-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-3H-indol-1-ium-2-yl]methyl]-3H-indol-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;10-[[4-[[4-[[1-[[4-[(2,7-dimethyl-9H-acridin-10-yl)methyl]phenyl]methyl]-2,3,6-trimethylpyridin-1-ium-4-yl]methyl]-2,3,6-trimethylpyridin-1-ium-1-yl]methyl]phenyl]methyl]-2,7-dimethyl-9H-acridine;ethane;(Z)-1-methyl-N-[(E)-[1-[[4-[[2,3,6-trimethyl-4-[[2,3,6-trimethyl-1-[[4-[[(2Z)-2-[(Z)-(1-methyl-3H-indol-2-ylidene)hydrazinylidene]-3H-indol-1-yl]methyl]phenyl]methyl]pyridin-1-ium-4-yl]methyl]pyridin-1-ium-1-yl]methyl]phenyl]methyl]-3H-indol-2-ylidene]amino]-3H-indol-2-imine is sourced from PubChem (CID 172962120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).