3-carbazol-9-yl-9-dibenzothiophen-2-ylcarbazole;3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]phenanthro[9,10-c]pyridine;3-[3-(6-phenyldibenzothiophen-4-yl)phenyl]phenanthro[9,10-c]pyridine;11-(3-triphenylen-2-ylphenyl)phenanthro[9,10-b]pyridine

C159H97N5S3 — CID 158485722

IUPAC3-carbazol-9-yl-9-dibenzothiophen-2-ylcarbazole;3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]phenanthro[9,10-c]pyridine;3-[3-(6-phenyldibenzothiophen-4-yl)phenyl]phenanthro[9,10-c]pyridine;11-(3-triphenylen-2-ylphenyl)phenanthro[9,10-b]pyridine
SMILESc1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)cc(-c2ccc3c4ccccc4c4cccnc4c3c2)c1.c1cc(-c2cccc(-c3cccc4c3sc3ccccc34)c2)cc(-c2cc3c4ccccc4c4ccccc4c3cn2)c1.c1ccc(-c2cccc3c2sc2c(-c4cccc(-c5cc6c7ccccc7c7ccccc7c6cn5)c4)cccc23)cc1.c1ccc2c(c1)sc1ccc(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)cc12
InChIInChI=1S/2C41H25NS.C41H25N.C36H22N2S/c1-3-16-33-31(14-1)32-15-2-4-17-34(32)38-25-42-39(24-37(33)38)29-13-8-11-27(23-29)26-10-7-12-28(22-26)30-19-9-20-36-35-18-5-6-21-40(35)43-41(30)36;1-2-11-26(12-3-1)29-19-9-21-35-36-22-10-20-30(41(36)43-40(29)35)27-13-8-14-28(23-27)39-24-37-33-17-6-4-15-31(33)32-16-5-7-18-34(32)38(37)25-42-39;1-2-13-32-30(11-1)31-12-4-6-16-35(31)39-24-28(18-20-36(32)39)26-9-7-10-27(23-26)29-19-21-37-33-14-3-5-15-34(33)38-17-8-22-42-41(38)40(37)25-29;1-5-13-31-25(9-1)26-10-2-6-14-32(26)37(31)23-17-19-34-29(21-23)27-11-3-7-15-33(27)38(34)24-18-20-36-30(22-24)28-12-4-8-16-35(28)39-36/h2*1-25H;1-25H;1-22H
InChIKeyHIBONAKJKNAZQW-UHFFFAOYSA-N
MW2173.76 g/mol
LogP45.40
Rot. Bonds10

About 3-carbazol-9-yl-9-dibenzothiophen-2-ylcarbazole;3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]phenanthro[9,10-c]pyridine;3-[3-(6-phenyldibenzothiophen-4-yl)phenyl]phenanthro[9,10-c]pyridine;11-(3-triphenylen-2-ylphenyl)phenanthro[9,10-b]pyridine

3-carbazol-9-yl-9-dibenzothiophen-2-ylcarbazole;3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]phenanthro[9,10-c]pyridine;3-[3-(6-phenyldibenzothiophen-4-yl)phenyl]phenanthro[9,10-c]pyridine;11-(3-triphenylen-2-ylphenyl)phenanthro[9,10-b]pyridine (PubChem CID 158485722) has the molecular formula C159H97N5S3 and a molecular weight of 2173.76 g/mol. Its IUPAC name is 3-carbazol-9-yl-9-dibenzothiophen-2-ylcarbazole;3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]phenanthro[9,10-c]pyridine;3-[3-(6-phenyldibenzothiophen-4-yl)phenyl]phenanthro[9,10-c]pyridine;11-(3-triphenylen-2-ylphenyl)phenanthro[9,10-b]pyridine.

Molecular Properties

Compound Name3-carbazol-9-yl-9-dibenzothiophen-2-ylcarbazole;3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]phenanthro[9,10-c]pyridine;3-[3-(6-phenyldibenzothiophen-4-yl)phenyl]phenanthro[9,10-c]pyridine;11-(3-triphenylen-2-ylphenyl)phenanthro[9,10-b]pyridine
PubChem CID158485722
Molecular FormulaC159H97N5S3
Molecular Weight2173.76 g/mol
Exact Mass2171.69
IUPAC Name3-carbazol-9-yl-9-dibenzothiophen-2-ylcarbazole;3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]phenanthro[9,10-c]pyridine;3-[3-(6-phenyldibenzothiophen-4-yl)phenyl]phenanthro[9,10-c]pyridine;11-(3-triphenylen-2-ylphenyl)phenanthro[9,10-b]pyridine
SMILESc1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)cc(-c2ccc3c4ccccc4c4cccnc4c3c2)c1.c1cc(-c2cccc(-c3cccc4c3sc3ccccc34)c2)cc(-c2cc3c4ccccc4c4ccccc4c3cn2)c1.c1ccc(-c2cccc3c2sc2c(-c4cccc(-c5cc6c7ccccc7c7ccccc7c6cn5)c4)cccc23)cc1.c1ccc2c(c1)sc1ccc(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)cc12
InChIInChI=1S/2C41H25NS.C41H25N.C36H22N2S/c1-3-16-33-31(14-1)32-15-2-4-17-34(32)38-25-42-39(24-37(33)38)29-13-8-11-27(23-29)26-10-7-12-28(22-26)30-19-9-20-36-35-18-5-6-21-40(35)43-41(30)36;1-2-11-26(12-3-1)29-19-9-21-35-36-22-10-20-30(41(36)43-40(29)35)27-13-8-14-28(23-27)39-24-37-33-17-6-4-15-31(33)32-16-5-7-18-34(32)38(37)25-42-39;1-2-13-32-30(11-1)31-12-4-6-16-35(31)39-24-28(18-20-36(32)39)26-9-7-10-27(23-26)29-19-21-37-33-14-3-5-15-34(33)38-17-8-22-42-41(38)40(37)25-29;1-5-13-31-25(9-1)26-10-2-6-14-32(26)37(31)23-17-19-34-29(21-23)27-11-3-7-15-33(27)38(34)24-18-20-36-30(22-24)28-12-4-8-16-35(28)39-36/h2*1-25H;1-25H;1-22H
InChIKeyHIBONAKJKNAZQW-UHFFFAOYSA-N
XLogP45.40
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds10
Heavy Atoms167
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002173.76
LogP ≤ 545.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 3-carbazol-9-yl-9-dibenzothiophen-2-ylcarbazole;3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]phenanthro[9,10-c]pyridine;3-[3-(6-phenyldibenzothiophen-4-yl)phenyl]phenanthro[9,10-c]pyridine;11-(3-triphenylen-2-ylphenyl)phenanthro[9,10-b]pyridine with MolForge

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Related Compounds

3-carbazol-9-yl-9-dibenzothiophen-2-ylcarbazole;3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]phenanthro[9,10-c]pyridine;3-[3-(6-phenyldibenzothiophen-4-yl)phenyl]phenanthro[9,10-c]pyridine;9-(3-triphenylen-2-ylphenyl)carbazole;11-(3-triphenylen-2-ylphenyl)phenanthro[9,10-b]pyridine
CID 161206982
3-[3-[3-(3-carbazol-9-yl-5-triphenylen-2-ylphenyl)-5-dibenzothiophen-4-ylphenyl]phenyl]phenanthro[9,10-c]pyridine
CID 135254958
3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]phenanthro[9,10-c]pyridine;7,7-dimethyl-5-phenyl-2-(3-triphenylen-2-ylphenyl)indeno[2,1-b]carbazole;methane;3-[3-(6-phenyldibenzothiophen-4-yl)phenyl]phenanthro[9,10-c]pyridine;4-(4-phenylphenyl)-6-triphenylen-2-yldibenzothiophene;9-phenyl-3-(3-triphenylen-2-ylphenyl)carbazole;4-phenyl-6-(3-triphenylen-2-ylphenyl)dibenzothiophene;4-triphenylen-2-yldibenzothiophene;9-(3-triphenylen-2-ylphenyl)carbazole
CID 162165414
3-carbazol-9-yl-9-dibenzothiophen-2-ylcarbazole;3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]phenanthro[9,10-c]pyridine;7,7-dimethyl-5-phenyl-2-(3-triphenylen-2-ylphenyl)indeno[2,1-b]carbazole;3-[3-(6-phenyldibenzothiophen-4-yl)phenyl]-1,2,3,4,8b,12a-hexahydrophenanthro[9,10-c]pyridine;4-(4-phenylphenyl)-6-triphenylen-2-yldibenzothiophene;9-phenyl-3-(3-triphenylen-2-ylphenyl)carbazole;4-phenyl-6-(3-triphenylen-2-ylphenyl)dibenzothiophene;4-triphenylen-2-yldibenzothiophene;9-(3-triphenylen-2-ylphenyl)carbazole;11-(3-triphenylen-2-ylphenyl)phenanthro[9,10-b]pyridine
CID 163748112
7-(3-carbazol-9-ylphenyl)-10-(3-dibenzothiophen-4-ylphenyl)phenanthro[9,10-b]pyrazine
CID 89417098
9-(7-heptacyclo[16.12.0.03,16.04,9.010,15.019,24.025,30]triaconta-1,3(16),4(9),5,7,10,12,14,17,19,21,23,25,27,29-pentadecaenyl)carbazole;4-(6-heptacyclo[16.12.0.03,16.04,9.010,15.019,24.025,30]triaconta-1,3(16),4(9),5,7,10,12,14,17,19,21,23,25,27,29-pentadecaenyl)dibenzothiophene;10-(7-heptacyclo[16.12.0.03,16.04,9.010,15.019,24.025,30]triaconta-1,3(16),4(9),5,7,10,12,14,17,19,21,23,25,27,29-pentadecaenyl)naphtho[1,2-b][1]benzothiole;9-[3-(7-heptacyclo[16.12.0.03,16.04,9.010,15.019,24.025,30]triaconta-1,3(16),4(9),5,7,10,12,14,17,19,21,23,25,27,29-pentadecaenyl)phenyl]carbazole;2-[3-(7-heptacyclo[16.12.0.03,16.04,9.010,15.019,24.025,30]triaconta-1,3(16),4(9),5,7,10,12,14,17,19,21,23,25,27,29-pentadecaenyl)phenyl]dibenzothiophene;4-[3-(6-heptacyclo[16.12.0.03,16.04,9.010,15.019,24.025,30]triaconta-1,3(16),4(9),5,7,10,12,14,17,19,21,23,25,27,29-pentadecaenyl)phenyl]dibenzothiophene;4-(7-heptacyclo[16.12.0.03,16.04,9.010,15.019,24.025,30]triaconta-1,3(16),4(9),5,7,10,12,14,17,19,21,23,25,27,29-pentadecaenyl)-6-phenyldibenzothiophene;10-[3-(7-heptacyclo[16.12.0.03,16.04,9.010,15.019,24.025,30]triaconta-1,3(16),4(9),5,7,10,12,14,17,19,21,23,25,27,29-pentadecaenyl)phenyl]naphtho[1,2-b][1]benzothiole;4-[3-(7-heptacyclo[16.12.0.03,16.04,9.010,15.019,24.025,30]triaconta-1,3(16),4(9),5,7,10,12,14,17,19,21,23,25,27,29-pentadecaenyl)phenyl]-6-phenyldibenzothiophene
CID 159632633
3-(6-phenyldibenzothiophen-4-yl)-9-triphenylen-2-ylcarbazole
CID 87156299
6-(3-carbazol-9-ylcarbazol-9-yl)-1-triphenylen-2-yl-[1]benzothiolo[2,3-c]pyridine;6-(3-carbazol-9-ylcarbazol-9-yl)-1-(3-triphenylen-2-ylphenyl)-[1]benzothiolo[2,3-c]pyridine;6-carbazol-9-yl-1-triphenylen-2-yl-[1]benzothiolo[2,3-c]pyridine
CID 160839103
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
9-(6-dibenzothiophen-4-yldibenzothiophen-2-yl)-3-phenylcarbazole
CID 123499174
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
3-carbazol-9-yl-9-[4-[2-(3-carbazol-9-ylphenyl)-4-dibenzothiophen-2-ylphenyl]-3-(3-dibenzothiophen-4-ylphenyl)phenyl]carbazole
CID 166807262

Frequently Asked Questions

What is the IUPAC name of 3-carbazol-9-yl-9-dibenzothiophen-2-ylcarbazole;3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]phenanthro[9,10-c]pyridine;3-[3-(6-phenyldibenzothiophen-4-yl)phenyl]phenanthro[9,10-c]pyridine;11-(3-triphenylen-2-ylphenyl)phenanthro[9,10-b]pyridine?
The IUPAC name of 3-carbazol-9-yl-9-dibenzothiophen-2-ylcarbazole;3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]phenanthro[9,10-c]pyridine;3-[3-(6-phenyldibenzothiophen-4-yl)phenyl]phenanthro[9,10-c]pyridine;11-(3-triphenylen-2-ylphenyl)phenanthro[9,10-b]pyridine (CID 158485722) is 3-carbazol-9-yl-9-dibenzothiophen-2-ylcarbazole;3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]phenanthro[9,10-c]pyridine;3-[3-(6-phenyldibenzothiophen-4-yl)phenyl]phenanthro[9,10-c]pyridine;11-(3-triphenylen-2-ylphenyl)phenanthro[9,10-b]pyridine.
What is the SMILES notation for 3-carbazol-9-yl-9-dibenzothiophen-2-ylcarbazole;3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]phenanthro[9,10-c]pyridine;3-[3-(6-phenyldibenzothiophen-4-yl)phenyl]phenanthro[9,10-c]pyridine;11-(3-triphenylen-2-ylphenyl)phenanthro[9,10-b]pyridine?
The canonical SMILES for 3-carbazol-9-yl-9-dibenzothiophen-2-ylcarbazole;3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]phenanthro[9,10-c]pyridine;3-[3-(6-phenyldibenzothiophen-4-yl)phenyl]phenanthro[9,10-c]pyridine;11-(3-triphenylen-2-ylphenyl)phenanthro[9,10-b]pyridine is c1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)cc(-c2ccc3c4ccccc4c4cccnc4c3c2)c1.c1cc(-c2cccc(-c3cccc4c3sc3ccccc34)c2)cc(-c2cc3c4ccccc4c4ccccc4c3cn2)c1.c1ccc(-c2cccc3c2sc2c(-c4cccc(-c5cc6c7ccccc7c7ccccc7c6cn5)c4)cccc23)cc1.c1ccc2c(c1)sc1ccc(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)cc12.
What is the InChIKey of 3-carbazol-9-yl-9-dibenzothiophen-2-ylcarbazole;3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]phenanthro[9,10-c]pyridine;3-[3-(6-phenyldibenzothiophen-4-yl)phenyl]phenanthro[9,10-c]pyridine;11-(3-triphenylen-2-ylphenyl)phenanthro[9,10-b]pyridine?
The InChIKey is HIBONAKJKNAZQW-UHFFFAOYSA-N. The full InChI is InChI=1S/2C41H25NS.C41H25N.C36H22N2S/c1-3-16-33-31(14-1)32-15-2-4-17-34(32)38-25-42-39(24-37(33)38)29-13-8-11-27(23-29)26-10-7-12-28(22-26)30-19-9-20-36-35-18-5-6-21-40(35)43-41(30)36;1-2-11-26(12-3-1)29-19-9-21-35-36-22-10-20-30(41(36)43-40(29)35)27-13-8-14-28(23-27)39-24-37-33-17-6-4-15-31(33)32-16-5-7-18-34(32)38(37)25-42-39;1-2-13-32-30(11-1)31-12-4-6-16-35(31)39-24-28(18-20-36(32)39)26-9-7-10-27(23-26)29-19-21-37-33-14-3-5-15-34(33)38-17-8-22-42-41(38)40(37)25-29;1-5-13-31-25(9-1)26-10-2-6-14-32(26)37(31)23-17-19-34-29(21-23)27-11-3-7-15-33(27)38(34)24-18-20-36-30(22-24)28-12-4-8-16-35(28)39-36/h2*1-25H;1-25H;1-22H.
What are the key properties of 3-carbazol-9-yl-9-dibenzothiophen-2-ylcarbazole;3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]phenanthro[9,10-c]pyridine;3-[3-(6-phenyldibenzothiophen-4-yl)phenyl]phenanthro[9,10-c]pyridine;11-(3-triphenylen-2-ylphenyl)phenanthro[9,10-b]pyridine?
3-carbazol-9-yl-9-dibenzothiophen-2-ylcarbazole;3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]phenanthro[9,10-c]pyridine;3-[3-(6-phenyldibenzothiophen-4-yl)phenyl]phenanthro[9,10-c]pyridine;11-(3-triphenylen-2-ylphenyl)phenanthro[9,10-b]pyridine has a molecular weight of 2173.76 g/mol, XLogP of 45.40, 10 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-carbazol-9-yl-9-dibenzothiophen-2-ylcarbazole;3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]phenanthro[9,10-c]pyridine;3-[3-(6-phenyldibenzothiophen-4-yl)phenyl]phenanthro[9,10-c]pyridine;11-(3-triphenylen-2-ylphenyl)phenanthro[9,10-b]pyridine is sourced from PubChem (CID 158485722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).