2-[2-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[3-phenyl-4-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[4-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;9-phenyl-1-[3-phenyl-2-(3-phenyl-2-benzothiophen-1-yl)phenyl]carbazole

C158H101NO3S4 — CID 158831031

IUPAC2-[2-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[3-phenyl-4-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[4-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;9-phenyl-1-[3-phenyl-2-(3-phenyl-2-benzothiophen-1-yl)phenyl]carbazole
SMILESc1ccc(-c2c(-c3ccc4oc5ccccc5c4c3)cccc2-c2sc(-c3ccccc3)c3ccccc23)cc1.c1ccc(-c2cc(-c3ccc4oc5ccccc5c4c3)ccc2-c2sc(-c3ccccc3)c3ccccc23)cc1.c1ccc(-c2ccc(-c3ccc4oc5ccccc5c4c3)cc2-c2sc(-c3ccccc3)c3ccccc23)cc1.c1ccc(-c2cccc(-c3cccc4c5ccccc5n(-c5ccccc5)c34)c2-c2sc(-c3ccccc3)c3ccccc23)cc1
InChIInChI=1S/C44H29NS.3C38H24OS/c1-4-16-30(17-5-1)33-25-14-26-35(41(33)44-39-24-11-10-23-38(39)43(46-44)31-18-6-2-7-19-31)37-28-15-27-36-34-22-12-13-29-40(34)45(42(36)37)32-20-8-3-9-21-32;1-3-12-25(13-4-1)36-28(27-22-23-35-33(24-27)29-16-9-10-21-34(29)39-35)19-11-20-32(36)38-31-18-8-7-17-30(31)37(40-38)26-14-5-2-6-15-26;1-3-11-25(12-4-1)29-21-19-27(28-20-22-36-33(23-28)30-15-9-10-18-35(30)39-36)24-34(29)38-32-17-8-7-16-31(32)37(40-38)26-13-5-2-6-14-26;1-3-11-25(12-4-1)33-23-27(28-20-22-36-34(24-28)29-15-9-10-18-35(29)39-36)19-21-32(33)38-31-17-8-7-16-30(31)37(40-38)26-13-5-2-6-14-26/h1-29H;3*1-24H
InChIKeyIXAWKUKGEBPYFQ-UHFFFAOYSA-N
MW2189.82 g/mol
LogP47.07
Rot. Bonds17

About 2-[2-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[3-phenyl-4-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[4-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;9-phenyl-1-[3-phenyl-2-(3-phenyl-2-benzothiophen-1-yl)phenyl]carbazole

2-[2-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[3-phenyl-4-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[4-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;9-phenyl-1-[3-phenyl-2-(3-phenyl-2-benzothiophen-1-yl)phenyl]carbazole (PubChem CID 158831031) has the molecular formula C158H101NO3S4 and a molecular weight of 2189.82 g/mol. Its IUPAC name is 2-[2-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[3-phenyl-4-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[4-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;9-phenyl-1-[3-phenyl-2-(3-phenyl-2-benzothiophen-1-yl)phenyl]carbazole.

Molecular Properties

Compound Name2-[2-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[3-phenyl-4-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[4-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;9-phenyl-1-[3-phenyl-2-(3-phenyl-2-benzothiophen-1-yl)phenyl]carbazole
PubChem CID158831031
Molecular FormulaC158H101NO3S4
Molecular Weight2189.82 g/mol
Exact Mass2187.67
IUPAC Name2-[2-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[3-phenyl-4-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[4-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;9-phenyl-1-[3-phenyl-2-(3-phenyl-2-benzothiophen-1-yl)phenyl]carbazole
SMILESc1ccc(-c2c(-c3ccc4oc5ccccc5c4c3)cccc2-c2sc(-c3ccccc3)c3ccccc23)cc1.c1ccc(-c2cc(-c3ccc4oc5ccccc5c4c3)ccc2-c2sc(-c3ccccc3)c3ccccc23)cc1.c1ccc(-c2ccc(-c3ccc4oc5ccccc5c4c3)cc2-c2sc(-c3ccccc3)c3ccccc23)cc1.c1ccc(-c2cccc(-c3cccc4c5ccccc5n(-c5ccccc5)c34)c2-c2sc(-c3ccccc3)c3ccccc23)cc1
InChIInChI=1S/C44H29NS.3C38H24OS/c1-4-16-30(17-5-1)33-25-14-26-35(41(33)44-39-24-11-10-23-38(39)43(46-44)31-18-6-2-7-19-31)37-28-15-27-36-34-22-12-13-29-40(34)45(42(36)37)32-20-8-3-9-21-32;1-3-12-25(13-4-1)36-28(27-22-23-35-33(24-27)29-16-9-10-21-34(29)39-35)19-11-20-32(36)38-31-18-8-7-17-30(31)37(40-38)26-14-5-2-6-15-26;1-3-11-25(12-4-1)29-21-19-27(28-20-22-36-33(23-28)30-15-9-10-18-35(30)39-36)24-34(29)38-32-17-8-7-16-31(32)37(40-38)26-13-5-2-6-14-26;1-3-11-25(12-4-1)33-23-27(28-20-22-36-34(24-28)29-15-9-10-18-35(29)39-36)19-21-32(33)38-31-17-8-7-16-30(31)37(40-38)26-13-5-2-6-14-26/h1-29H;3*1-24H
InChIKeyIXAWKUKGEBPYFQ-UHFFFAOYSA-N
XLogP47.07
TPSA44.35 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds17
Heavy Atoms166
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002189.82
LogP ≤ 547.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 2-[2-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[3-phenyl-4-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[4-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;9-phenyl-1-[3-phenyl-2-(3-phenyl-2-benzothiophen-1-yl)phenyl]carbazole with MolForge

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Related Compounds

8-[4-(2,6-diphenylphenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-12-phenyl-[1]benzofuro[2,3-a]carbazole
CID 153460204
1-[4-(3-dibenzofuran-2-yl-2-phenylphenyl)-6-dibenzothiophen-2-yl-1,3,5-triazin-2-yl]-9-(9-phenylcarbazol-1-yl)carbazole
CID 168807788
1-[2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]-9-phenylcarbazole
CID 170191958
1-[7-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 139342651
N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-[4-(2-phenylphenyl)phenyl]dibenzofuran-2-amine
CID 164790790
1-dibenzofuran-3-yl-9-phenylcarbazole
CID 137466533
3-(2-dibenzofuran-2-ylphenyl)-9-phenylcarbazole
CID 139423478
1-[4-(2,5-diphenylphenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-12-phenyl-[1]benzofuro[3,2-a]carbazole
CID 153459573
9-[4-(4-dibenzofuran-3-ylphenyl)phenyl]-1-phenylcarbazole
CID 163676020
1-[4-(3,4-diphenylphenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-12-phenyl-[1]benzofuro[3,2-a]carbazole
CID 153460080
6-[4-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-1,9-diphenylcarbazole
CID 155201179
6-[3-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-1,9-diphenylcarbazole
CID 155201210

Frequently Asked Questions

What is the IUPAC name of 2-[2-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[3-phenyl-4-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[4-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;9-phenyl-1-[3-phenyl-2-(3-phenyl-2-benzothiophen-1-yl)phenyl]carbazole?
The IUPAC name of 2-[2-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[3-phenyl-4-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[4-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;9-phenyl-1-[3-phenyl-2-(3-phenyl-2-benzothiophen-1-yl)phenyl]carbazole (CID 158831031) is 2-[2-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[3-phenyl-4-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[4-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;9-phenyl-1-[3-phenyl-2-(3-phenyl-2-benzothiophen-1-yl)phenyl]carbazole.
What is the SMILES notation for 2-[2-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[3-phenyl-4-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[4-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;9-phenyl-1-[3-phenyl-2-(3-phenyl-2-benzothiophen-1-yl)phenyl]carbazole?
The canonical SMILES for 2-[2-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[3-phenyl-4-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[4-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;9-phenyl-1-[3-phenyl-2-(3-phenyl-2-benzothiophen-1-yl)phenyl]carbazole is c1ccc(-c2c(-c3ccc4oc5ccccc5c4c3)cccc2-c2sc(-c3ccccc3)c3ccccc23)cc1.c1ccc(-c2cc(-c3ccc4oc5ccccc5c4c3)ccc2-c2sc(-c3ccccc3)c3ccccc23)cc1.c1ccc(-c2ccc(-c3ccc4oc5ccccc5c4c3)cc2-c2sc(-c3ccccc3)c3ccccc23)cc1.c1ccc(-c2cccc(-c3cccc4c5ccccc5n(-c5ccccc5)c34)c2-c2sc(-c3ccccc3)c3ccccc23)cc1.
What is the InChIKey of 2-[2-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[3-phenyl-4-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[4-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;9-phenyl-1-[3-phenyl-2-(3-phenyl-2-benzothiophen-1-yl)phenyl]carbazole?
The InChIKey is IXAWKUKGEBPYFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H29NS.3C38H24OS/c1-4-16-30(17-5-1)33-25-14-26-35(41(33)44-39-24-11-10-23-38(39)43(46-44)31-18-6-2-7-19-31)37-28-15-27-36-34-22-12-13-29-40(34)45(42(36)37)32-20-8-3-9-21-32;1-3-12-25(13-4-1)36-28(27-22-23-35-33(24-27)29-16-9-10-21-34(29)39-35)19-11-20-32(36)38-31-18-8-7-17-30(31)37(40-38)26-14-5-2-6-15-26;1-3-11-25(12-4-1)29-21-19-27(28-20-22-36-33(23-28)30-15-9-10-18-35(30)39-36)24-34(29)38-32-17-8-7-16-31(32)37(40-38)26-13-5-2-6-14-26;1-3-11-25(12-4-1)33-23-27(28-20-22-36-34(24-28)29-15-9-10-18-35(29)39-36)19-21-32(33)38-31-17-8-7-16-30(31)37(40-38)26-13-5-2-6-14-26/h1-29H;3*1-24H.
What are the key properties of 2-[2-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[3-phenyl-4-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[4-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;9-phenyl-1-[3-phenyl-2-(3-phenyl-2-benzothiophen-1-yl)phenyl]carbazole?
2-[2-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[3-phenyl-4-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[4-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;9-phenyl-1-[3-phenyl-2-(3-phenyl-2-benzothiophen-1-yl)phenyl]carbazole has a molecular weight of 2189.82 g/mol, XLogP of 47.07, 17 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[3-phenyl-4-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;2-[4-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)phenyl]dibenzofuran;9-phenyl-1-[3-phenyl-2-(3-phenyl-2-benzothiophen-1-yl)phenyl]carbazole is sourced from PubChem (CID 158831031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).