9-(3-dibenzofuran-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-2-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(4-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-3-yl)phenyl]-2-triphenylen-2-ylcarbazole

C294H186N6OS3 — CID 159453257

IUPAC9-(3-dibenzofuran-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-2-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(4-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-3-yl)phenyl]-2-triphenylen-2-ylcarbazole
SMILESCC1(C)c2ccccc2-c2cc(-c3cccc(-n4c5ccccc5c5ccc(-c6ccc7c8ccccc8c8ccccc8c7c6)cc54)c3)ccc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(-n4c5ccccc5c5ccc(-c6ccc7c8ccccc8c8ccccc8c7c6)cc54)c3)cc21.c1cc(-c2ccc3sc4ccccc4c3c2)cc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc32)c1.c1cc(-c2cccc3c2oc2ccccc23)cc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc32)c1.c1cc(-c2cccc3c2sc2ccccc23)cc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc32)c1.c1ccc2c(c1)sc1c(-c3ccc(-n4c5ccccc5c5ccc(-c6ccc7c8ccccc8c8ccccc8c7c6)cc54)cc3)cccc12
InChIInChI=1S/2C51H35N.C48H29NO.3C48H29NS/c1-51(2)47-20-9-7-18-42(47)46-30-34(24-27-48(46)51)32-12-11-13-36(28-32)52-49-21-10-8-19-43(49)44-26-23-35(31-50(44)52)33-22-25-41-39-16-4-3-14-37(39)38-15-5-6-17-40(38)45(41)29-33;1-51(2)47-20-9-7-18-42(47)43-26-23-34(30-48(43)51)32-12-11-13-36(28-32)52-49-21-10-8-19-44(49)45-27-24-35(31-50(45)52)33-22-25-41-39-16-4-3-14-37(39)38-15-5-6-17-40(38)46(41)29-33;2*1-2-15-37-35(13-1)36-14-3-4-16-38(36)44-28-30(23-25-39(37)44)31-24-26-41-40-17-5-7-21-45(40)49(46(41)29-31)33-12-9-11-32(27-33)34-19-10-20-43-42-18-6-8-22-47(42)50-48(34)43;1-2-14-37-35(12-1)36-13-3-4-15-38(36)43-27-31(20-23-39(37)43)33-21-24-41-40-16-5-7-18-45(40)49(46(41)29-33)34-11-9-10-30(26-34)32-22-25-48-44(28-32)42-17-6-8-19-47(42)50-48;1-2-12-37-35(10-1)36-11-3-4-13-38(36)44-28-31(22-26-39(37)44)32-23-27-41-40-14-5-7-18-45(40)49(46(41)29-32)33-24-20-30(21-25-33)34-16-9-17-43-42-15-6-8-19-47(42)50-48(34)43/h2*3-31H,1-2H3;4*1-29H
InChIKeyLTQLUOOFCKEIHJ-UHFFFAOYSA-N
MW3914.96 g/mol
LogP83.08
Rot. Bonds18

About 9-(3-dibenzofuran-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-2-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(4-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-3-yl)phenyl]-2-triphenylen-2-ylcarbazole

9-(3-dibenzofuran-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-2-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(4-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-3-yl)phenyl]-2-triphenylen-2-ylcarbazole (PubChem CID 159453257) has the molecular formula C294H186N6OS3 and a molecular weight of 3914.96 g/mol. Its IUPAC name is 9-(3-dibenzofuran-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-2-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(4-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-3-yl)phenyl]-2-triphenylen-2-ylcarbazole.

Molecular Properties

Compound Name9-(3-dibenzofuran-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-2-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(4-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-3-yl)phenyl]-2-triphenylen-2-ylcarbazole
PubChem CID159453257
Molecular FormulaC294H186N6OS3
Molecular Weight3914.96 g/mol
Exact Mass3911.39
IUPAC Name9-(3-dibenzofuran-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-2-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(4-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-3-yl)phenyl]-2-triphenylen-2-ylcarbazole
SMILESCC1(C)c2ccccc2-c2cc(-c3cccc(-n4c5ccccc5c5ccc(-c6ccc7c8ccccc8c8ccccc8c7c6)cc54)c3)ccc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(-n4c5ccccc5c5ccc(-c6ccc7c8ccccc8c8ccccc8c7c6)cc54)c3)cc21.c1cc(-c2ccc3sc4ccccc4c3c2)cc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc32)c1.c1cc(-c2cccc3c2oc2ccccc23)cc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc32)c1.c1cc(-c2cccc3c2sc2ccccc23)cc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc32)c1.c1ccc2c(c1)sc1c(-c3ccc(-n4c5ccccc5c5ccc(-c6ccc7c8ccccc8c8ccccc8c7c6)cc54)cc3)cccc12
InChIInChI=1S/2C51H35N.C48H29NO.3C48H29NS/c1-51(2)47-20-9-7-18-42(47)46-30-34(24-27-48(46)51)32-12-11-13-36(28-32)52-49-21-10-8-19-43(49)44-26-23-35(31-50(44)52)33-22-25-41-39-16-4-3-14-37(39)38-15-5-6-17-40(38)45(41)29-33;1-51(2)47-20-9-7-18-42(47)43-26-23-34(30-48(43)51)32-12-11-13-36(28-32)52-49-21-10-8-19-44(49)45-27-24-35(31-50(45)52)33-22-25-41-39-16-4-3-14-37(39)38-15-5-6-17-40(38)46(41)29-33;2*1-2-15-37-35(13-1)36-14-3-4-16-38(36)44-28-30(23-25-39(37)44)31-24-26-41-40-17-5-7-21-45(40)49(46(41)29-31)33-12-9-11-32(27-33)34-19-10-20-43-42-18-6-8-22-47(42)50-48(34)43;1-2-14-37-35(12-1)36-13-3-4-15-38(36)43-27-31(20-23-39(37)43)33-21-24-41-40-16-5-7-18-45(40)49(46(41)29-33)34-11-9-10-30(26-34)32-22-25-48-44(28-32)42-17-6-8-19-47(42)50-48;1-2-12-37-35(10-1)36-11-3-4-13-38(36)44-28-31(22-26-39(37)44)32-23-27-41-40-14-5-7-18-45(40)49(46(41)29-32)33-24-20-30(21-25-33)34-16-9-17-43-42-15-6-8-19-47(42)50-48(34)43/h2*3-31H,1-2H3;4*1-29H
InChIKeyLTQLUOOFCKEIHJ-UHFFFAOYSA-N
XLogP83.08
TPSA42.72 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds18
Heavy Atoms304
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003914.96
LogP ≤ 583.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 9-(3-dibenzofuran-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-2-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(4-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-3-yl)phenyl]-2-triphenylen-2-ylcarbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-(3-dibenzofuran-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-2-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(4-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-3-yl)phenyl]-2-triphenylen-2-ylcarbazole?
The IUPAC name of 9-(3-dibenzofuran-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-2-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(4-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-3-yl)phenyl]-2-triphenylen-2-ylcarbazole (CID 159453257) is 9-(3-dibenzofuran-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-2-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(4-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-3-yl)phenyl]-2-triphenylen-2-ylcarbazole.
What is the SMILES notation for 9-(3-dibenzofuran-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-2-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(4-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-3-yl)phenyl]-2-triphenylen-2-ylcarbazole?
The canonical SMILES for 9-(3-dibenzofuran-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-2-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(4-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-3-yl)phenyl]-2-triphenylen-2-ylcarbazole is CC1(C)c2ccccc2-c2cc(-c3cccc(-n4c5ccccc5c5ccc(-c6ccc7c8ccccc8c8ccccc8c7c6)cc54)c3)ccc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(-n4c5ccccc5c5ccc(-c6ccc7c8ccccc8c8ccccc8c7c6)cc54)c3)cc21.c1cc(-c2ccc3sc4ccccc4c3c2)cc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc32)c1.c1cc(-c2cccc3c2oc2ccccc23)cc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc32)c1.c1cc(-c2cccc3c2sc2ccccc23)cc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc32)c1.c1ccc2c(c1)sc1c(-c3ccc(-n4c5ccccc5c5ccc(-c6ccc7c8ccccc8c8ccccc8c7c6)cc54)cc3)cccc12.
What is the InChIKey of 9-(3-dibenzofuran-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-2-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(4-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-3-yl)phenyl]-2-triphenylen-2-ylcarbazole?
The InChIKey is LTQLUOOFCKEIHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C51H35N.C48H29NO.3C48H29NS/c1-51(2)47-20-9-7-18-42(47)46-30-34(24-27-48(46)51)32-12-11-13-36(28-32)52-49-21-10-8-19-43(49)44-26-23-35(31-50(44)52)33-22-25-41-39-16-4-3-14-37(39)38-15-5-6-17-40(38)45(41)29-33;1-51(2)47-20-9-7-18-42(47)43-26-23-34(30-48(43)51)32-12-11-13-36(28-32)52-49-21-10-8-19-44(49)45-27-24-35(31-50(45)52)33-22-25-41-39-16-4-3-14-37(39)38-15-5-6-17-40(38)46(41)29-33;2*1-2-15-37-35(13-1)36-14-3-4-16-38(36)44-28-30(23-25-39(37)44)31-24-26-41-40-17-5-7-21-45(40)49(46(41)29-31)33-12-9-11-32(27-33)34-19-10-20-43-42-18-6-8-22-47(42)50-48(34)43;1-2-14-37-35(12-1)36-13-3-4-15-38(36)43-27-31(20-23-39(37)43)33-21-24-41-40-16-5-7-18-45(40)49(46(41)29-33)34-11-9-10-30(26-34)32-22-25-48-44(28-32)42-17-6-8-19-47(42)50-48;1-2-12-37-35(10-1)36-11-3-4-13-38(36)44-28-31(22-26-39(37)44)32-23-27-41-40-14-5-7-18-45(40)49(46(41)29-32)33-24-20-30(21-25-33)34-16-9-17-43-42-15-6-8-19-47(42)50-48(34)43/h2*3-31H,1-2H3;4*1-29H.
What are the key properties of 9-(3-dibenzofuran-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-2-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(4-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-3-yl)phenyl]-2-triphenylen-2-ylcarbazole?
9-(3-dibenzofuran-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-2-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(4-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-3-yl)phenyl]-2-triphenylen-2-ylcarbazole has a molecular weight of 3914.96 g/mol, XLogP of 83.08, 18 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(3-dibenzofuran-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-2-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(4-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-3-yl)phenyl]-2-triphenylen-2-ylcarbazole is sourced from PubChem (CID 159453257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).