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

C108H68N4S2 — CID 157394578

IUPAC4-(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
SMILESc1ccc(-c2ccc(-c3cc(-n4c5ccccc5c5c(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cccc54)cc4c3sc3ccccc34)cc2)cc1.c1ccc(-c2cccc(-c3cc(-n4c5ccccc5c5c(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cccc54)cc4c3sc3ccccc34)c2)cc1
InChIInChI=1S/2C54H34N2S/c1-3-15-35(16-4-1)36-17-13-18-37(31-36)46-33-40(34-47-44-22-9-12-28-52(44)57-54(46)47)56-49-26-11-8-23-45(49)53-41(24-14-27-50(53)56)38-29-30-43-42-21-7-10-25-48(42)55(51(43)32-38)39-19-5-2-6-20-39;1-3-14-35(15-4-1)36-26-28-37(29-27-36)46-33-40(34-47-44-19-9-12-25-52(44)57-54(46)47)56-49-23-11-8-20-45(49)53-41(21-13-24-50(53)56)38-30-31-43-42-18-7-10-22-48(42)55(51(43)32-38)39-16-5-2-6-17-39/h2*1-34H
InChIKeyBMKMAQQBWNZPSZ-UHFFFAOYSA-N
MW1485.89 g/mol
LogP30.50
Rot. Bonds10

About 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

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 (PubChem CID 157394578) has the molecular formula C108H68N4S2 and a molecular weight of 1485.89 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name4-(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
PubChem CID157394578
Molecular FormulaC108H68N4S2
Molecular Weight1485.89 g/mol
Exact Mass1484.49
IUPAC Name4-(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
SMILESc1ccc(-c2ccc(-c3cc(-n4c5ccccc5c5c(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cccc54)cc4c3sc3ccccc34)cc2)cc1.c1ccc(-c2cccc(-c3cc(-n4c5ccccc5c5c(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cccc54)cc4c3sc3ccccc34)c2)cc1
InChIInChI=1S/2C54H34N2S/c1-3-15-35(16-4-1)36-17-13-18-37(31-36)46-33-40(34-47-44-22-9-12-28-52(44)57-54(46)47)56-49-26-11-8-23-45(49)53-41(24-14-27-50(53)56)38-29-30-43-42-21-7-10-25-48(42)55(51(43)32-38)39-19-5-2-6-20-39;1-3-14-35(15-4-1)36-26-28-37(29-27-36)46-33-40(34-47-44-19-9-12-25-52(44)57-54(46)47)56-49-23-11-8-20-45(49)53-41(21-13-24-50(53)56)38-30-31-43-42-18-7-10-22-48(42)55(51(43)32-38)39-16-5-2-6-17-39/h2*1-34H
InChIKeyBMKMAQQBWNZPSZ-UHFFFAOYSA-N
XLogP30.50
TPSA19.72 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms114
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001485.89
LogP ≤ 530.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 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 with MolForge

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Related Compounds

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
N,4-diphenyl-N-[4-[2-(2-phenylcarbazol-9-yl)dibenzothiophen-4-yl]phenyl]aniline
CID 156521456
2-[9-[4-(4-dibenzothiophen-1-ylphenyl)phenyl]carbazol-4-yl]-9-phenylcarbazole
CID 166510060
2-[9-(4-dibenzothiophen-1-ylphenyl)carbazol-4-yl]-9-phenylcarbazole
CID 166510069
4-(4,6-diphenylpyrimidin-2-yl)-9-[4-(4-phenylphenyl)dibenzothiophen-2-yl]carbazole
CID 139556200
2-[9-(3-dibenzothiophen-1-ylphenyl)carbazol-4-yl]-9-phenylcarbazole
CID 166510074
2-dibenzothiophen-4-yl-9-phenyl-6-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole
CID 129087238
4-[9-(3,5-diphenylphenyl)carbazol-2-yl]-9-(3-phenylphenyl)carbazole
CID 165386046
4-[9-[4-(3,5-diphenylphenyl)phenyl]carbazol-2-yl]-9-phenylcarbazole
CID 118231228
methane;3-[9-(4-naphthalen-1-yldibenzothiophen-2-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-2-yldibenzothiophen-2-yl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[4-(3-phenylphenyl)dibenzothiophen-2-yl]carbazole
CID 158321384
9-(4-dibenzothiophen-4-ylphenyl)-5-(3-phenylphenyl)-3-[9-(2-phenylphenyl)carbazol-3-yl]carbazole
CID 139319601
2-[3-dibenzothiophen-4-yl-5-(3-phenylphenyl)phenyl]-9-[3-(3-phenylphenyl)phenyl]carbazole
CID 122492281

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is c1ccc(-c2ccc(-c3cc(-n4c5ccccc5c5c(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cccc54)cc4c3sc3ccccc34)cc2)cc1.c1ccc(-c2cccc(-c3cc(-n4c5ccccc5c5c(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cccc54)cc4c3sc3ccccc34)c2)cc1.
What is the InChIKey of 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?
The InChIKey is BMKMAQQBWNZPSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C54H34N2S/c1-3-15-35(16-4-1)36-17-13-18-37(31-36)46-33-40(34-47-44-22-9-12-28-52(44)57-54(46)47)56-49-26-11-8-23-45(49)53-41(24-14-27-50(53)56)38-29-30-43-42-21-7-10-25-48(42)55(51(43)32-38)39-19-5-2-6-20-39;1-3-14-35(15-4-1)36-26-28-37(29-27-36)46-33-40(34-47-44-19-9-12-25-52(44)57-54(46)47)56-49-23-11-8-20-45(49)53-41(21-13-24-50(53)56)38-30-31-43-42-18-7-10-22-48(42)55(51(43)32-38)39-16-5-2-6-17-39/h2*1-34H.
What are the key properties of 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?
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 has a molecular weight of 1485.89 g/mol, XLogP of 30.50, 10 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 157394578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).