1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis[4-(4-phenylphenyl)phenyl]indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-diphenylindole

C186H117N3O6 — CID 158939023

IUPAC1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis[4-(4-phenylphenyl)phenyl]indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-diphenylindole
SMILESc1ccc(-c2ccc(-c3ccc(-c4ccc5c(c4)c(-c4ccc(-c6ccc(-c7ccccc7)cc6)cc4)cn5-c4cc(-c5ccc6oc7ccccc7c6c5)cc(-c5ccc6oc7ccccc7c6c5)c4)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc4c(c3)c(-c3ccc(-c5ccccc5)cc3)cn4-c3cc(-c4ccc5oc6ccccc6c5c4)cc(-c4ccc5oc6ccccc6c5c4)c3)cc2)cc1.c1ccc(-c2ccc3c(c2)c(-c2ccccc2)cn3-c2cc(-c3ccc4oc5ccccc5c4c3)cc(-c3ccc4oc5ccccc5c4c3)c2)cc1
InChIInChI=1S/C74H47NO2.C62H39NO2.C50H31NO2/c1-3-11-48(12-4-1)50-19-23-52(24-20-50)54-27-29-56(30-28-54)58-35-38-70-66(44-58)69(57-33-31-55(32-34-57)53-25-21-51(22-26-53)49-13-5-2-6-14-49)47-75(70)63-42-61(59-36-39-73-67(45-59)64-15-7-9-17-71(64)76-73)41-62(43-63)60-37-40-74-68(46-60)65-16-8-10-18-72(65)77-74;1-3-11-40(12-4-1)42-19-21-44(22-20-42)46-27-30-58-54(36-46)57(45-25-23-43(24-26-45)41-13-5-2-6-14-41)39-63(58)51-34-49(47-28-31-61-55(37-47)52-15-7-9-17-59(52)64-61)33-50(35-51)48-29-32-62-56(38-48)53-16-8-10-18-60(53)65-62;1-3-11-32(12-4-1)34-19-22-46-42(28-34)45(33-13-5-2-6-14-33)31-51(46)39-26-37(35-20-23-49-43(29-35)40-15-7-9-17-47(40)52-49)25-38(27-39)36-21-24-50-44(30-36)41-16-8-10-18-48(41)53-50/h1-47H;1-39H;1-31H
InChIKeyJKABKCMGZFSNIY-UHFFFAOYSA-N
MW2490.00 g/mol
LogP52.29
Rot. Bonds21

About 1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis[4-(4-phenylphenyl)phenyl]indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-diphenylindole

1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis[4-(4-phenylphenyl)phenyl]indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-diphenylindole (PubChem CID 158939023) has the molecular formula C186H117N3O6 and a molecular weight of 2490.00 g/mol. Its IUPAC name is 1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis[4-(4-phenylphenyl)phenyl]indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-diphenylindole.

Molecular Properties

Compound Name1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis[4-(4-phenylphenyl)phenyl]indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-diphenylindole
PubChem CID158939023
Molecular FormulaC186H117N3O6
Molecular Weight2490.00 g/mol
Exact Mass2487.89
IUPAC Name1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis[4-(4-phenylphenyl)phenyl]indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-diphenylindole
SMILESc1ccc(-c2ccc(-c3ccc(-c4ccc5c(c4)c(-c4ccc(-c6ccc(-c7ccccc7)cc6)cc4)cn5-c4cc(-c5ccc6oc7ccccc7c6c5)cc(-c5ccc6oc7ccccc7c6c5)c4)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc4c(c3)c(-c3ccc(-c5ccccc5)cc3)cn4-c3cc(-c4ccc5oc6ccccc6c5c4)cc(-c4ccc5oc6ccccc6c5c4)c3)cc2)cc1.c1ccc(-c2ccc3c(c2)c(-c2ccccc2)cn3-c2cc(-c3ccc4oc5ccccc5c4c3)cc(-c3ccc4oc5ccccc5c4c3)c2)cc1
InChIInChI=1S/C74H47NO2.C62H39NO2.C50H31NO2/c1-3-11-48(12-4-1)50-19-23-52(24-20-50)54-27-29-56(30-28-54)58-35-38-70-66(44-58)69(57-33-31-55(32-34-57)53-25-21-51(22-26-53)49-13-5-2-6-14-49)47-75(70)63-42-61(59-36-39-73-67(45-59)64-15-7-9-17-71(64)76-73)41-62(43-63)60-37-40-74-68(46-60)65-16-8-10-18-72(65)77-74;1-3-11-40(12-4-1)42-19-21-44(22-20-42)46-27-30-58-54(36-46)57(45-25-23-43(24-26-45)41-13-5-2-6-14-41)39-63(58)51-34-49(47-28-31-61-55(37-47)52-15-7-9-17-59(52)64-61)33-50(35-51)48-29-32-62-56(38-48)53-16-8-10-18-60(53)65-62;1-3-11-32(12-4-1)34-19-22-46-42(28-34)45(33-13-5-2-6-14-33)31-51(46)39-26-37(35-20-23-49-43(29-35)40-15-7-9-17-47(40)52-49)25-38(27-39)36-21-24-50-44(30-36)41-16-8-10-18-48(41)53-50/h1-47H;1-39H;1-31H
InChIKeyJKABKCMGZFSNIY-UHFFFAOYSA-N
XLogP52.29
TPSA93.63 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds21
Heavy Atoms195
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002490.00
LogP ≤ 552.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis[4-(4-phenylphenyl)phenyl]indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-diphenylindole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis[4-(4-phenylphenyl)phenyl]indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-diphenylindole?
The IUPAC name of 1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis[4-(4-phenylphenyl)phenyl]indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-diphenylindole (CID 158939023) is 1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis[4-(4-phenylphenyl)phenyl]indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-diphenylindole.
What is the SMILES notation for 1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis[4-(4-phenylphenyl)phenyl]indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-diphenylindole?
The canonical SMILES for 1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis[4-(4-phenylphenyl)phenyl]indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-diphenylindole is c1ccc(-c2ccc(-c3ccc(-c4ccc5c(c4)c(-c4ccc(-c6ccc(-c7ccccc7)cc6)cc4)cn5-c4cc(-c5ccc6oc7ccccc7c6c5)cc(-c5ccc6oc7ccccc7c6c5)c4)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc4c(c3)c(-c3ccc(-c5ccccc5)cc3)cn4-c3cc(-c4ccc5oc6ccccc6c5c4)cc(-c4ccc5oc6ccccc6c5c4)c3)cc2)cc1.c1ccc(-c2ccc3c(c2)c(-c2ccccc2)cn3-c2cc(-c3ccc4oc5ccccc5c4c3)cc(-c3ccc4oc5ccccc5c4c3)c2)cc1.
What is the InChIKey of 1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis[4-(4-phenylphenyl)phenyl]indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-diphenylindole?
The InChIKey is JKABKCMGZFSNIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H47NO2.C62H39NO2.C50H31NO2/c1-3-11-48(12-4-1)50-19-23-52(24-20-50)54-27-29-56(30-28-54)58-35-38-70-66(44-58)69(57-33-31-55(32-34-57)53-25-21-51(22-26-53)49-13-5-2-6-14-49)47-75(70)63-42-61(59-36-39-73-67(45-59)64-15-7-9-17-71(64)76-73)41-62(43-63)60-37-40-74-68(46-60)65-16-8-10-18-72(65)77-74;1-3-11-40(12-4-1)42-19-21-44(22-20-42)46-27-30-58-54(36-46)57(45-25-23-43(24-26-45)41-13-5-2-6-14-41)39-63(58)51-34-49(47-28-31-61-55(37-47)52-15-7-9-17-59(52)64-61)33-50(35-51)48-29-32-62-56(38-48)53-16-8-10-18-60(53)65-62;1-3-11-32(12-4-1)34-19-22-46-42(28-34)45(33-13-5-2-6-14-33)31-51(46)39-26-37(35-20-23-49-43(29-35)40-15-7-9-17-47(40)52-49)25-38(27-39)36-21-24-50-44(30-36)41-16-8-10-18-48(41)53-50/h1-47H;1-39H;1-31H.
What are the key properties of 1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis[4-(4-phenylphenyl)phenyl]indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-diphenylindole?
1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis[4-(4-phenylphenyl)phenyl]indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-diphenylindole has a molecular weight of 2490.00 g/mol, XLogP of 52.29, 21 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis[4-(4-phenylphenyl)phenyl]indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-diphenylindole is sourced from PubChem (CID 158939023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).