2-chloro-6-dibenzofuran-2-yl-9-naphthalen-2-ylcarbazole;2-chloro-6-dibenzofuran-2-yl-9-(4-phenylphenyl)carbazole;2-chloro-6-dibenzothiophen-2-yl-9-naphthalen-1-ylcarbazole;2-chloro-6-dibenzothiophen-2-yl-9-phenylcarbazole

C134H80Cl4N4O2S2 — CID 159786007

IUPAC2-chloro-6-dibenzofuran-2-yl-9-naphthalen-2-ylcarbazole;2-chloro-6-dibenzofuran-2-yl-9-(4-phenylphenyl)carbazole;2-chloro-6-dibenzothiophen-2-yl-9-naphthalen-1-ylcarbazole;2-chloro-6-dibenzothiophen-2-yl-9-phenylcarbazole
SMILESClc1ccc2c3cc(-c4ccc5oc6ccccc6c5c4)ccc3n(-c3ccc(-c4ccccc4)cc3)c2c1.Clc1ccc2c3cc(-c4ccc5oc6ccccc6c5c4)ccc3n(-c3ccc4ccccc4c3)c2c1.Clc1ccc2c3cc(-c4ccc5sc6ccccc6c5c4)ccc3n(-c3cccc4ccccc34)c2c1.Clc1ccc2c3cc(-c4ccc5sc6ccccc6c5c4)ccc3n(-c3ccccc3)c2c1
InChIInChI=1S/C36H22ClNO.C34H20ClNO.C34H20ClNS.C30H18ClNS/c37-27-14-17-29-31-20-25(26-13-19-36-32(21-26)30-8-4-5-9-35(30)39-36)12-18-33(31)38(34(29)22-27)28-15-10-24(11-16-28)23-6-2-1-3-7-23;35-25-12-14-27-29-18-23(24-11-16-34-30(19-24)28-7-3-4-8-33(28)37-34)10-15-31(29)36(32(27)20-25)26-13-9-21-5-1-2-6-22(21)17-26;35-24-14-15-26-28-18-22(23-13-17-34-29(19-23)27-9-3-4-11-33(27)37-34)12-16-31(28)36(32(26)20-24)30-10-5-7-21-6-1-2-8-25(21)30;31-21-12-13-23-25-16-19(10-14-27(25)32(28(23)18-21)22-6-2-1-3-7-22)20-11-15-30-26(17-20)24-8-4-5-9-29(24)33-30/h1-22H;2*1-20H;1-18H
InChIKeyNHYMXMWCICKFDG-UHFFFAOYSA-N
MW1984.09 g/mol
LogP40.92
Rot. Bonds9

About 2-chloro-6-dibenzofuran-2-yl-9-naphthalen-2-ylcarbazole;2-chloro-6-dibenzofuran-2-yl-9-(4-phenylphenyl)carbazole;2-chloro-6-dibenzothiophen-2-yl-9-naphthalen-1-ylcarbazole;2-chloro-6-dibenzothiophen-2-yl-9-phenylcarbazole

2-chloro-6-dibenzofuran-2-yl-9-naphthalen-2-ylcarbazole;2-chloro-6-dibenzofuran-2-yl-9-(4-phenylphenyl)carbazole;2-chloro-6-dibenzothiophen-2-yl-9-naphthalen-1-ylcarbazole;2-chloro-6-dibenzothiophen-2-yl-9-phenylcarbazole (PubChem CID 159786007) has the molecular formula C134H80Cl4N4O2S2 and a molecular weight of 1984.09 g/mol. Its IUPAC name is 2-chloro-6-dibenzofuran-2-yl-9-naphthalen-2-ylcarbazole;2-chloro-6-dibenzofuran-2-yl-9-(4-phenylphenyl)carbazole;2-chloro-6-dibenzothiophen-2-yl-9-naphthalen-1-ylcarbazole;2-chloro-6-dibenzothiophen-2-yl-9-phenylcarbazole.

Molecular Properties

Compound Name2-chloro-6-dibenzofuran-2-yl-9-naphthalen-2-ylcarbazole;2-chloro-6-dibenzofuran-2-yl-9-(4-phenylphenyl)carbazole;2-chloro-6-dibenzothiophen-2-yl-9-naphthalen-1-ylcarbazole;2-chloro-6-dibenzothiophen-2-yl-9-phenylcarbazole
PubChem CID159786007
Molecular FormulaC134H80Cl4N4O2S2
Molecular Weight1984.09 g/mol
Exact Mass1980.45
IUPAC Name2-chloro-6-dibenzofuran-2-yl-9-naphthalen-2-ylcarbazole;2-chloro-6-dibenzofuran-2-yl-9-(4-phenylphenyl)carbazole;2-chloro-6-dibenzothiophen-2-yl-9-naphthalen-1-ylcarbazole;2-chloro-6-dibenzothiophen-2-yl-9-phenylcarbazole
SMILESClc1ccc2c3cc(-c4ccc5oc6ccccc6c5c4)ccc3n(-c3ccc(-c4ccccc4)cc3)c2c1.Clc1ccc2c3cc(-c4ccc5oc6ccccc6c5c4)ccc3n(-c3ccc4ccccc4c3)c2c1.Clc1ccc2c3cc(-c4ccc5sc6ccccc6c5c4)ccc3n(-c3cccc4ccccc34)c2c1.Clc1ccc2c3cc(-c4ccc5sc6ccccc6c5c4)ccc3n(-c3ccccc3)c2c1
InChIInChI=1S/C36H22ClNO.C34H20ClNO.C34H20ClNS.C30H18ClNS/c37-27-14-17-29-31-20-25(26-13-19-36-32(21-26)30-8-4-5-9-35(30)39-36)12-18-33(31)38(34(29)22-27)28-15-10-24(11-16-28)23-6-2-1-3-7-23;35-25-12-14-27-29-18-23(24-11-16-34-30(19-24)28-7-3-4-8-33(28)37-34)10-15-31(29)36(32(27)20-25)26-13-9-21-5-1-2-6-22(21)17-26;35-24-14-15-26-28-18-22(23-13-17-34-29(19-23)27-9-3-4-11-33(27)37-34)12-16-31(28)36(32(26)20-24)30-10-5-7-21-6-1-2-8-25(21)30;31-21-12-13-23-25-16-19(10-14-27(25)32(28(23)18-21)22-6-2-1-3-7-22)20-11-15-30-26(17-20)24-8-4-5-9-29(24)33-30/h1-22H;2*1-20H;1-18H
InChIKeyNHYMXMWCICKFDG-UHFFFAOYSA-N
XLogP40.92
TPSA46.00 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms146
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001984.09
LogP ≤ 540.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 2-chloro-6-dibenzofuran-2-yl-9-naphthalen-2-ylcarbazole;2-chloro-6-dibenzofuran-2-yl-9-(4-phenylphenyl)carbazole;2-chloro-6-dibenzothiophen-2-yl-9-naphthalen-1-ylcarbazole;2-chloro-6-dibenzothiophen-2-yl-9-phenylcarbazole with MolForge

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Related Compounds

3-dibenzofuran-2-yl-9-phenylcarbazole;3-dibenzofuran-2-yl-9-(3-phenylphenyl)carbazole;3-dibenzothiophen-2-yl-9-naphthalen-2-ylcarbazole;3-dibenzothiophen-2-yl-9-phenylcarbazole;3-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole
CID 158742909
2-(9-dibenzofuran-3-ylcarbazol-3-yl)-9-naphthalen-1-ylcarbazole;2-(9-dibenzofuran-3-ylcarbazol-3-yl)-9-naphthalen-2-ylcarbazole;2-(9-dibenzofuran-3-ylcarbazol-3-yl)-9-phenylcarbazole;2-(9-dibenzofuran-3-ylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 161318809
3-dibenzofuran-2-yl-9-phenylcarbazole;3-dibenzothiophen-2-yl-9-phenylcarbazole;3-dibenzothiophen-2-yl-9-(3-phenylphenyl)carbazole;9-phenyl-2-(9-phenylcarbazol-3-yl)carbazole
CID 157163023
9-dibenzofuran-2-yl-3-[2-(9-phenylcarbazol-3-yl)carbazol-9-yl]carbazole;9-dibenzothiophen-2-yl-3-[2-(9-phenylcarbazol-3-yl)carbazol-9-yl]carbazole;2-(9-phenylcarbazol-3-yl)-9-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 157326935
3-dibenzofuran-2-yl-9-(4-naphthalen-1-ylphenyl)carbazole;3-dibenzothiophen-2-yl-9-(4-naphthalen-2-ylphenyl)carbazole
CID 159777371
3-dibenzofuran-2-yl-9-phenylcarbazole;3-dibenzothiophen-2-yl-9-phenylcarbazole;3-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole
CID 160651391
9-dibenzofuran-2-yl-3-dibenzothiophen-2-ylcarbazole;3-dibenzofuran-2-yl-9-(3-phenylphenyl)carbazole;3,9-di(dibenzothiophen-2-yl)carbazole
CID 158258330
3-dibenzofuran-2-yl-9-phenyl-6-[9-phenyl-6-[3-[3-(3-phenylphenyl)phenyl]phenyl]carbazol-3-yl]carbazole;3-dibenzothiophen-2-yl-9-phenyl-6-[9-phenyl-6-[3-[3-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazol-3-yl]carbazole
CID 158998789
3-(8-dibenzofuran-1-yldibenzothiophen-2-yl)-6-[4-[6-dibenzothiophen-2-yl-9-(3-phenylphenyl)carbazol-3-yl]phenyl]-9-naphthalen-1-ylcarbazole;3-[3-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]-9-phenylcarbazole;9-phenyl-3-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole;tetratriaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33-heptadecayne
CID 159203974
3-(8-dibenzofuran-1-yldibenzothiophen-2-yl)-6-[6-dibenzothiophen-2-yl-9-(3-phenylphenyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole
CID 137466565
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-(8-phenyldibenzofuran-2-yl)carbazole;3-(9-dibenzothiophen-2-ylcarbazol-3-yl)-9-(8-phenyldibenzothiophen-2-yl)carbazole;9-(8-phenyldibenzothiophen-2-yl)-3-[9-(8-phenyldibenzothiophen-2-yl)carbazol-3-yl]carbazole
CID 161271655
9-dibenzofuran-2-yl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;9-dibenzothiophen-2-yl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3,6,9-tris(9-phenylcarbazol-3-yl)carbazole
CID 161382413

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-dibenzofuran-2-yl-9-naphthalen-2-ylcarbazole;2-chloro-6-dibenzofuran-2-yl-9-(4-phenylphenyl)carbazole;2-chloro-6-dibenzothiophen-2-yl-9-naphthalen-1-ylcarbazole;2-chloro-6-dibenzothiophen-2-yl-9-phenylcarbazole?
The IUPAC name of 2-chloro-6-dibenzofuran-2-yl-9-naphthalen-2-ylcarbazole;2-chloro-6-dibenzofuran-2-yl-9-(4-phenylphenyl)carbazole;2-chloro-6-dibenzothiophen-2-yl-9-naphthalen-1-ylcarbazole;2-chloro-6-dibenzothiophen-2-yl-9-phenylcarbazole (CID 159786007) is 2-chloro-6-dibenzofuran-2-yl-9-naphthalen-2-ylcarbazole;2-chloro-6-dibenzofuran-2-yl-9-(4-phenylphenyl)carbazole;2-chloro-6-dibenzothiophen-2-yl-9-naphthalen-1-ylcarbazole;2-chloro-6-dibenzothiophen-2-yl-9-phenylcarbazole.
What is the SMILES notation for 2-chloro-6-dibenzofuran-2-yl-9-naphthalen-2-ylcarbazole;2-chloro-6-dibenzofuran-2-yl-9-(4-phenylphenyl)carbazole;2-chloro-6-dibenzothiophen-2-yl-9-naphthalen-1-ylcarbazole;2-chloro-6-dibenzothiophen-2-yl-9-phenylcarbazole?
The canonical SMILES for 2-chloro-6-dibenzofuran-2-yl-9-naphthalen-2-ylcarbazole;2-chloro-6-dibenzofuran-2-yl-9-(4-phenylphenyl)carbazole;2-chloro-6-dibenzothiophen-2-yl-9-naphthalen-1-ylcarbazole;2-chloro-6-dibenzothiophen-2-yl-9-phenylcarbazole is Clc1ccc2c3cc(-c4ccc5oc6ccccc6c5c4)ccc3n(-c3ccc(-c4ccccc4)cc3)c2c1.Clc1ccc2c3cc(-c4ccc5oc6ccccc6c5c4)ccc3n(-c3ccc4ccccc4c3)c2c1.Clc1ccc2c3cc(-c4ccc5sc6ccccc6c5c4)ccc3n(-c3cccc4ccccc34)c2c1.Clc1ccc2c3cc(-c4ccc5sc6ccccc6c5c4)ccc3n(-c3ccccc3)c2c1.
What is the InChIKey of 2-chloro-6-dibenzofuran-2-yl-9-naphthalen-2-ylcarbazole;2-chloro-6-dibenzofuran-2-yl-9-(4-phenylphenyl)carbazole;2-chloro-6-dibenzothiophen-2-yl-9-naphthalen-1-ylcarbazole;2-chloro-6-dibenzothiophen-2-yl-9-phenylcarbazole?
The InChIKey is NHYMXMWCICKFDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H22ClNO.C34H20ClNO.C34H20ClNS.C30H18ClNS/c37-27-14-17-29-31-20-25(26-13-19-36-32(21-26)30-8-4-5-9-35(30)39-36)12-18-33(31)38(34(29)22-27)28-15-10-24(11-16-28)23-6-2-1-3-7-23;35-25-12-14-27-29-18-23(24-11-16-34-30(19-24)28-7-3-4-8-33(28)37-34)10-15-31(29)36(32(27)20-25)26-13-9-21-5-1-2-6-22(21)17-26;35-24-14-15-26-28-18-22(23-13-17-34-29(19-23)27-9-3-4-11-33(27)37-34)12-16-31(28)36(32(26)20-24)30-10-5-7-21-6-1-2-8-25(21)30;31-21-12-13-23-25-16-19(10-14-27(25)32(28(23)18-21)22-6-2-1-3-7-22)20-11-15-30-26(17-20)24-8-4-5-9-29(24)33-30/h1-22H;2*1-20H;1-18H.
What are the key properties of 2-chloro-6-dibenzofuran-2-yl-9-naphthalen-2-ylcarbazole;2-chloro-6-dibenzofuran-2-yl-9-(4-phenylphenyl)carbazole;2-chloro-6-dibenzothiophen-2-yl-9-naphthalen-1-ylcarbazole;2-chloro-6-dibenzothiophen-2-yl-9-phenylcarbazole?
2-chloro-6-dibenzofuran-2-yl-9-naphthalen-2-ylcarbazole;2-chloro-6-dibenzofuran-2-yl-9-(4-phenylphenyl)carbazole;2-chloro-6-dibenzothiophen-2-yl-9-naphthalen-1-ylcarbazole;2-chloro-6-dibenzothiophen-2-yl-9-phenylcarbazole has a molecular weight of 1984.09 g/mol, XLogP of 40.92, 9 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-dibenzofuran-2-yl-9-naphthalen-2-ylcarbazole;2-chloro-6-dibenzofuran-2-yl-9-(4-phenylphenyl)carbazole;2-chloro-6-dibenzothiophen-2-yl-9-naphthalen-1-ylcarbazole;2-chloro-6-dibenzothiophen-2-yl-9-phenylcarbazole is sourced from PubChem (CID 159786007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).