2-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole;2-dibenzothiophen-4-yl-9-(4-phenylphenyl)carbazole;4-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole

C108H69N3S3 — CID 157492203

IUPAC2-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole;2-dibenzothiophen-4-yl-9-(4-phenylphenyl)carbazole;4-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4c(-c5ccc6sc7ccccc7c6c5)cccc43)cc2)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4ccc(-c5ccc6sc7ccccc7c6c5)cc43)cc2)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4ccc(-c5cccc6c5sc5ccccc56)cc43)cc2)cc1
InChIInChI=1S/3C36H23NS/c1-2-9-24(10-3-1)25-17-20-27(21-18-25)37-32-14-6-4-12-30(32)36-28(13-8-15-33(36)37)26-19-22-35-31(23-26)29-11-5-7-16-34(29)38-35;1-2-9-24(10-3-1)25-17-20-27(21-18-25)37-33-15-6-4-11-29(33)30-22-19-26(23-34(30)37)28-13-8-14-32-31-12-5-7-16-35(31)38-36(28)32;1-2-8-24(9-3-1)25-14-18-28(19-15-25)37-33-12-6-4-10-29(33)30-20-16-27(23-34(30)37)26-17-21-36-32(22-26)31-11-5-7-13-35(31)38-36/h3*1-23H
InChIKeyBXKKAQRLTUJUSK-UHFFFAOYSA-N
MW1504.96 g/mol
LogP31.46
Rot. Bonds9

About 2-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole;2-dibenzothiophen-4-yl-9-(4-phenylphenyl)carbazole;4-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole

2-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole;2-dibenzothiophen-4-yl-9-(4-phenylphenyl)carbazole;4-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole (PubChem CID 157492203) has the molecular formula C108H69N3S3 and a molecular weight of 1504.96 g/mol. Its IUPAC name is 2-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole;2-dibenzothiophen-4-yl-9-(4-phenylphenyl)carbazole;4-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole.

Molecular Properties

Compound Name2-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole;2-dibenzothiophen-4-yl-9-(4-phenylphenyl)carbazole;4-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole
PubChem CID157492203
Molecular FormulaC108H69N3S3
Molecular Weight1504.96 g/mol
Exact Mass1503.47
IUPAC Name2-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole;2-dibenzothiophen-4-yl-9-(4-phenylphenyl)carbazole;4-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4c(-c5ccc6sc7ccccc7c6c5)cccc43)cc2)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4ccc(-c5ccc6sc7ccccc7c6c5)cc43)cc2)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4ccc(-c5cccc6c5sc5ccccc56)cc43)cc2)cc1
InChIInChI=1S/3C36H23NS/c1-2-9-24(10-3-1)25-17-20-27(21-18-25)37-32-14-6-4-12-30(32)36-28(13-8-15-33(36)37)26-19-22-35-31(23-26)29-11-5-7-16-34(29)38-35;1-2-9-24(10-3-1)25-17-20-27(21-18-25)37-33-15-6-4-11-29(33)30-22-19-26(23-34(30)37)28-13-8-14-32-31-12-5-7-16-35(31)38-36(28)32;1-2-8-24(9-3-1)25-14-18-28(19-15-25)37-33-12-6-4-10-29(33)30-20-16-27(23-34(30)37)26-17-21-36-32(22-26)31-11-5-7-13-35(31)38-36/h3*1-23H
InChIKeyBXKKAQRLTUJUSK-UHFFFAOYSA-N
XLogP31.46
TPSA14.79 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms114
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001504.96
LogP ≤ 531.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole;2-dibenzothiophen-4-yl-9-(4-phenylphenyl)carbazole;4-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole with MolForge

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Related Compounds

9-[4-(4-dibenzothiophen-2-ylphenyl)phenyl]-4-phenylcarbazole
CID 163988724
3-dibenzothiophen-2-yl-6-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;3-dibenzothiophen-3-yl-6-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;3-dibenzothiophen-4-yl-6-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 159995207
2-[9-(2-dibenzothiophen-2-ylphenyl)carbazol-4-yl]-9-phenylcarbazole
CID 166510089
3-[9-(4-dibenzothiophen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-dibenzothiophen-2-ylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-(4-dibenzothiophen-4-ylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 159577303
2-dibenzothiophen-4-yl-9-phenyl-6-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole
CID 129087238
9-(4-dibenzothiophen-4-ylphenyl)-5-(3-phenylphenyl)-3-[9-(2-phenylphenyl)carbazol-3-yl]carbazole
CID 139319601
4-(9-phenylcarbazol-2-yl)-9-[4-(3-phenylphenyl)dibenzothiophen-2-yl]carbazole;4-(9-phenylcarbazol-2-yl)-9-[4-(4-phenylphenyl)dibenzothiophen-2-yl]carbazole
CID 157394578
9-(8-dibenzothiophen-1-yldibenzothiophen-4-yl)-2-phenylcarbazole;9-(8-dibenzothiophen-2-yldibenzothiophen-4-yl)-2-phenylcarbazole;9-(8-dibenzothiophen-3-yldibenzothiophen-4-yl)-2-phenylcarbazole;9-(8-dibenzothiophen-4-yldibenzothiophen-4-yl)-2-phenylcarbazole
CID 158873491
3-dibenzothiophen-2-yl-9-phenyl-6-[9-(3-phenylphenyl)carbazol-3-yl]carbazole;3-dibenzothiophen-3-yl-9-phenyl-6-[9-(3-phenylphenyl)carbazol-3-yl]carbazole;3-dibenzothiophen-4-yl-9-phenyl-6-[9-(3-phenylphenyl)carbazol-3-yl]carbazole
CID 158760951
3-(9-dibenzothiophen-2-ylcarbazol-4-yl)-9-(3-phenylphenyl)carbazole
CID 165386154
2-[9-[4-(4-dibenzothiophen-1-ylphenyl)phenyl]carbazol-4-yl]-9-phenylcarbazole
CID 166510060
3-dibenzothiophen-4-yl-6-[9-(4-methylphenyl)carbazol-3-yl]-9-phenylcarbazole;2-phenyl-6-(9-phenylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole;3-phenyl-6-(9-phenylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole
CID 159869296

Frequently Asked Questions

What is the IUPAC name of 2-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole;2-dibenzothiophen-4-yl-9-(4-phenylphenyl)carbazole;4-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole?
The IUPAC name of 2-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole;2-dibenzothiophen-4-yl-9-(4-phenylphenyl)carbazole;4-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole (CID 157492203) is 2-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole;2-dibenzothiophen-4-yl-9-(4-phenylphenyl)carbazole;4-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole.
What is the SMILES notation for 2-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole;2-dibenzothiophen-4-yl-9-(4-phenylphenyl)carbazole;4-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole?
The canonical SMILES for 2-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole;2-dibenzothiophen-4-yl-9-(4-phenylphenyl)carbazole;4-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole is c1ccc(-c2ccc(-n3c4ccccc4c4c(-c5ccc6sc7ccccc7c6c5)cccc43)cc2)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4ccc(-c5ccc6sc7ccccc7c6c5)cc43)cc2)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4ccc(-c5cccc6c5sc5ccccc56)cc43)cc2)cc1.
What is the InChIKey of 2-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole;2-dibenzothiophen-4-yl-9-(4-phenylphenyl)carbazole;4-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole?
The InChIKey is BXKKAQRLTUJUSK-UHFFFAOYSA-N. The full InChI is InChI=1S/3C36H23NS/c1-2-9-24(10-3-1)25-17-20-27(21-18-25)37-32-14-6-4-12-30(32)36-28(13-8-15-33(36)37)26-19-22-35-31(23-26)29-11-5-7-16-34(29)38-35;1-2-9-24(10-3-1)25-17-20-27(21-18-25)37-33-15-6-4-11-29(33)30-22-19-26(23-34(30)37)28-13-8-14-32-31-12-5-7-16-35(31)38-36(28)32;1-2-8-24(9-3-1)25-14-18-28(19-15-25)37-33-12-6-4-10-29(33)30-20-16-27(23-34(30)37)26-17-21-36-32(22-26)31-11-5-7-13-35(31)38-36/h3*1-23H.
What are the key properties of 2-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole;2-dibenzothiophen-4-yl-9-(4-phenylphenyl)carbazole;4-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole?
2-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole;2-dibenzothiophen-4-yl-9-(4-phenylphenyl)carbazole;4-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole has a molecular weight of 1504.96 g/mol, XLogP of 31.46, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole;2-dibenzothiophen-4-yl-9-(4-phenylphenyl)carbazole;4-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole is sourced from PubChem (CID 157492203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).