5,6-diphenyl-2-(5-phenylquinolin-8-yl)indolo[2,3-b]indole;5-(2,6-diphenyl-4-pyridinyl)-6-phenylindolo[2,3-b]indole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenyl-[1]benzofuro[3,2-b]indole

C113H74N10O — CID 157108186

IUPAC5,6-diphenyl-2-(5-phenylquinolin-8-yl)indolo[2,3-b]indole;5-(2,6-diphenyl-4-pyridinyl)-6-phenylindolo[2,3-b]indole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenyl-[1]benzofuro[3,2-b]indole
SMILESc1ccc(-c2cc(-n3c4ccccc4c4c5ccccc5n(-c5ccccc5)c43)cc(-c3ccccc3)n2)cc1.c1ccc(-c2ccc(-c3ccc4c(c3)c3c5ccccc5n(-c5ccccc5)c3n4-c3ccccc3)c3ncccc23)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3oc3c5ccccc5n(-c5ccccc5)c43)n2)cc1
InChIInChI=1S/C41H27N3.C37H25N3.C35H22N4O/c1-4-13-28(14-5-1)32-23-24-33(40-34(32)20-12-26-42-40)29-22-25-38-36(27-29)39-35-19-10-11-21-37(35)43(30-15-6-2-7-16-30)41(39)44(38)31-17-8-3-9-18-31;1-4-14-26(15-5-1)32-24-29(25-33(38-32)27-16-6-2-7-17-27)40-35-23-13-11-21-31(35)36-30-20-10-12-22-34(30)39(37(36)40)28-18-8-3-9-19-28;1-4-13-23(14-5-1)33-36-34(24-15-6-2-7-16-24)38-35(37-33)28-21-12-20-27-30-32(40-31(27)28)26-19-10-11-22-29(26)39(30)25-17-8-3-9-18-25/h1-27H;1-25H;1-22H
InChIKeyAGNVSAODXDVPLL-UHFFFAOYSA-N
MW1587.90 g/mol
LogP28.78
Rot. Bonds12

About 5,6-diphenyl-2-(5-phenylquinolin-8-yl)indolo[2,3-b]indole;5-(2,6-diphenyl-4-pyridinyl)-6-phenylindolo[2,3-b]indole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenyl-[1]benzofuro[3,2-b]indole

5,6-diphenyl-2-(5-phenylquinolin-8-yl)indolo[2,3-b]indole;5-(2,6-diphenyl-4-pyridinyl)-6-phenylindolo[2,3-b]indole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenyl-[1]benzofuro[3,2-b]indole (PubChem CID 157108186) has the molecular formula C113H74N10O and a molecular weight of 1587.90 g/mol. Its IUPAC name is 5,6-diphenyl-2-(5-phenylquinolin-8-yl)indolo[2,3-b]indole;5-(2,6-diphenyl-4-pyridinyl)-6-phenylindolo[2,3-b]indole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenyl-[1]benzofuro[3,2-b]indole.

Molecular Properties

Compound Name5,6-diphenyl-2-(5-phenylquinolin-8-yl)indolo[2,3-b]indole;5-(2,6-diphenyl-4-pyridinyl)-6-phenylindolo[2,3-b]indole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenyl-[1]benzofuro[3,2-b]indole
PubChem CID157108186
Molecular FormulaC113H74N10O
Molecular Weight1587.90 g/mol
Exact Mass1586.60
IUPAC Name5,6-diphenyl-2-(5-phenylquinolin-8-yl)indolo[2,3-b]indole;5-(2,6-diphenyl-4-pyridinyl)-6-phenylindolo[2,3-b]indole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenyl-[1]benzofuro[3,2-b]indole
SMILESc1ccc(-c2cc(-n3c4ccccc4c4c5ccccc5n(-c5ccccc5)c43)cc(-c3ccccc3)n2)cc1.c1ccc(-c2ccc(-c3ccc4c(c3)c3c5ccccc5n(-c5ccccc5)c3n4-c3ccccc3)c3ncccc23)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3oc3c5ccccc5n(-c5ccccc5)c43)n2)cc1
InChIInChI=1S/C41H27N3.C37H25N3.C35H22N4O/c1-4-13-28(14-5-1)32-23-24-33(40-34(32)20-12-26-42-40)29-22-25-38-36(27-29)39-35-19-10-11-21-37(35)43(30-15-6-2-7-16-30)41(39)44(38)31-17-8-3-9-18-31;1-4-14-26(15-5-1)32-24-29(25-33(38-32)27-16-6-2-7-17-27)40-35-23-13-11-21-31(35)36-30-20-10-12-22-34(30)39(37(36)40)28-18-8-3-9-19-28;1-4-13-23(14-5-1)33-36-34(24-15-6-2-7-16-24)38-35(37-33)28-21-12-20-27-30-32(40-31(27)28)26-19-10-11-22-29(26)39(30)25-17-8-3-9-18-25/h1-27H;1-25H;1-22H
InChIKeyAGNVSAODXDVPLL-UHFFFAOYSA-N
XLogP28.78
TPSA102.24 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds12
Heavy Atoms124
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001587.90
LogP ≤ 528.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 5,6-diphenyl-2-(5-phenylquinolin-8-yl)indolo[2,3-b]indole;5-(2,6-diphenyl-4-pyridinyl)-6-phenylindolo[2,3-b]indole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenyl-[1]benzofuro[3,2-b]indole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3H-dibenzofuran-3-id-2-yl)-1-[2,6-di(propan-2-yl)phenyl]imidazole;3-(2,6-dimethylphenyl)-7-(2,2-dimethylpropyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;1-(2,6-dimethylphenyl)-2-phenylimidazole;1-[2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;pentakis(iridium);2-phenylpyridine;platinum;2-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine
CID 158170112
9,23-Bis[3-methyl-5-(trifluoromethyl)phenyl]-7,9,21,23-tetrazaoctacyclo[13.13.2.02,10.03,8.012,29.016,24.017,22.026,30]triaconta-1(29),2(10),3(8),4,6,11,13,15(30),16(24),17(22),18,20,25,27-tetradecaene;9,23-di(dibenzofuran-3-yl)-7,9,21,23-tetrazaoctacyclo[13.13.2.02,10.03,8.012,29.016,24.017,22.026,30]triaconta-1(29),2(10),3(8),4,6,11,13,15(30),16(24),17(22),18,20,25,27-tetradecaene
CID 159322276
2,6-Bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-methyl-6-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[2-methyl-6-(trifluoromethyl)phenyl]benzonitrile;methane;4-[2-methyl-6-(trifluoromethyl)phenyl]-2,6-bis(2-pyrimidin-2-ylcarbazol-9-yl)benzonitrile;4-[2-methyl-6-(trifluoromethyl)phenyl]-2,6-bis(3-pyrimidin-2-ylcarbazol-9-yl)benzonitrile
CID 161276231
9-[4-[(1S)-2-[4-[3,6-bis(trifluoromethyl)carbazol-9-yl]phenyl]-3,6-dicyclohexylcyclohexyl]phenyl]-3,6-di(propan-2-yl)carbazole;6-[4-[(2S)-2-(4-carbazol-9-ylphenyl)cyclopentyl]phenyl]dibenzofuran-2-carbonitrile;4-[4-[(2R)-2-(4-carbazol-9-ylphenyl)-1,2-dimethylcyclohexyl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-[4-[(2S)-2-(4-carbazol-9-ylphenyl)-1,2-di(propan-2-yl)cyclohexyl]phenyl]-[1]benzofuro[3,2-b]pyridine;9-[4-[(1R)-2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,2-dimethylcyclohexyl]phenyl]-3-phenylcarbazole;9-[4-[(1S)-2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-di(propan-2-yl)cyclohexyl]phenyl]carbazole
CID 162203926
N,N-bis[4-(1,8-naphthyridin-2-yl)phenyl]-6-[3-(trifluoromethyl)-[1]benzofuro[3,2-b]pyridin-4-yl]naphthalen-2-amine
CID 168765517
2-carbazol-9-id-1-yl-1-phenyl-4-[9-pyridin-2-yl-6-(trifluoromethyl)-1H-carbazol-1-id-2-yl]-[1]benzofuro[2,3-e]benzimidazole;platinum(2+)
CID 176643308
Iridium;2-phenyl-1-(2,4,6-trimethylphenyl)imidazole;8-[2-[5-[3-[5-[4-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]benzene-5-id-1-yl]hexan-3-yl]phenyl]pyrido[3,2-b]indol-8-yl]dibenzofuran-4-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 58059020
10-[9-[8-[3,6-Bis(2-pyridin-2-ylphenyl)carbazol-9-yl]dibenzofuran-4-yl]carbazol-3-yl]-4-(3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaene
CID 58099588
6-[9-[8-[3,6-Bis(2-pyridin-2-ylphenyl)carbazol-9-yl]dibenzofuran-4-yl]carbazol-3-yl]-4,12-bis(3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 58099626
8-[8-[3-[3,6-Bis[2-(1,3,5-triazin-2-yl)phenyl]carbazol-9-yl]phenyl]dibenzofuran-4-yl]-5-phenylpyrido[4,3-b]indole
CID 58099790
9-Phenyl-3-[8-(9-phenyl-5-pyrimidin-2-ylcarbazol-3-yl)dibenzofuran-2-yl]-5-pyrimidin-2-ylcarbazole
CID 58501595
3-Dibenzofuran-2-yl-9-[3-[9-[4-[2,4-dimethyl-4-[4-[1-(2,3,4,5,6-pentamethylphenyl)imidazol-2-yl]benzene-5-id-1-yl]hexan-2-yl]phenyl]carbazol-3-yl]phenyl]carbazole;iridium(3+);bis(1-(2,3,4,5,6-pentamethylphenyl)-2-phenylimidazole)
CID 59196768

Frequently Asked Questions

What is the IUPAC name of 5,6-diphenyl-2-(5-phenylquinolin-8-yl)indolo[2,3-b]indole;5-(2,6-diphenyl-4-pyridinyl)-6-phenylindolo[2,3-b]indole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenyl-[1]benzofuro[3,2-b]indole?
The IUPAC name of 5,6-diphenyl-2-(5-phenylquinolin-8-yl)indolo[2,3-b]indole;5-(2,6-diphenyl-4-pyridinyl)-6-phenylindolo[2,3-b]indole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenyl-[1]benzofuro[3,2-b]indole (CID 157108186) is 5,6-diphenyl-2-(5-phenylquinolin-8-yl)indolo[2,3-b]indole;5-(2,6-diphenyl-4-pyridinyl)-6-phenylindolo[2,3-b]indole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenyl-[1]benzofuro[3,2-b]indole.
What is the SMILES notation for 5,6-diphenyl-2-(5-phenylquinolin-8-yl)indolo[2,3-b]indole;5-(2,6-diphenyl-4-pyridinyl)-6-phenylindolo[2,3-b]indole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenyl-[1]benzofuro[3,2-b]indole?
The canonical SMILES for 5,6-diphenyl-2-(5-phenylquinolin-8-yl)indolo[2,3-b]indole;5-(2,6-diphenyl-4-pyridinyl)-6-phenylindolo[2,3-b]indole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenyl-[1]benzofuro[3,2-b]indole is c1ccc(-c2cc(-n3c4ccccc4c4c5ccccc5n(-c5ccccc5)c43)cc(-c3ccccc3)n2)cc1.c1ccc(-c2ccc(-c3ccc4c(c3)c3c5ccccc5n(-c5ccccc5)c3n4-c3ccccc3)c3ncccc23)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3oc3c5ccccc5n(-c5ccccc5)c43)n2)cc1.
What is the InChIKey of 5,6-diphenyl-2-(5-phenylquinolin-8-yl)indolo[2,3-b]indole;5-(2,6-diphenyl-4-pyridinyl)-6-phenylindolo[2,3-b]indole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenyl-[1]benzofuro[3,2-b]indole?
The InChIKey is AGNVSAODXDVPLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H27N3.C37H25N3.C35H22N4O/c1-4-13-28(14-5-1)32-23-24-33(40-34(32)20-12-26-42-40)29-22-25-38-36(27-29)39-35-19-10-11-21-37(35)43(30-15-6-2-7-16-30)41(39)44(38)31-17-8-3-9-18-31;1-4-14-26(15-5-1)32-24-29(25-33(38-32)27-16-6-2-7-17-27)40-35-23-13-11-21-31(35)36-30-20-10-12-22-34(30)39(37(36)40)28-18-8-3-9-19-28;1-4-13-23(14-5-1)33-36-34(24-15-6-2-7-16-24)38-35(37-33)28-21-12-20-27-30-32(40-31(27)28)26-19-10-11-22-29(26)39(30)25-17-8-3-9-18-25/h1-27H;1-25H;1-22H.
What are the key properties of 5,6-diphenyl-2-(5-phenylquinolin-8-yl)indolo[2,3-b]indole;5-(2,6-diphenyl-4-pyridinyl)-6-phenylindolo[2,3-b]indole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenyl-[1]benzofuro[3,2-b]indole?
5,6-diphenyl-2-(5-phenylquinolin-8-yl)indolo[2,3-b]indole;5-(2,6-diphenyl-4-pyridinyl)-6-phenylindolo[2,3-b]indole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenyl-[1]benzofuro[3,2-b]indole has a molecular weight of 1587.90 g/mol, XLogP of 28.78, 12 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-diphenyl-2-(5-phenylquinolin-8-yl)indolo[2,3-b]indole;5-(2,6-diphenyl-4-pyridinyl)-6-phenylindolo[2,3-b]indole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenyl-[1]benzofuro[3,2-b]indole is sourced from PubChem (CID 157108186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).