5-(2-cyano-6-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(3-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(4-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(5-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile

C152H76N12O4S4 — CID 159168684

IUPAC5-(2-cyano-6-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(3-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(4-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(5-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile
SMILESN#Cc1ccc(-c2ccc3oc4ccccc4c3c2)c(-n2c3ccccc3c3c4sc5c(C#N)cccc5c4ccc32)c1.N#Cc1ccc(-n2c3ccccc3c3c4sc5c(C#N)cccc5c4ccc32)c(-c2ccc3oc4ccccc4c3c2)c1.N#Cc1cccc(-c2ccc3oc4ccccc4c3c2)c1-n1c2ccccc2c2c3sc4c(C#N)cccc4c3ccc21.N#Cc1cccc(-n2c3ccccc3c3c4sc5c(C#N)cccc5c4ccc32)c1-c1ccc2oc3ccccc3c2c1
InChIInChI=1S/4C38H19N3OS/c39-20-23-7-6-13-31(35(23)22-15-18-34-29(19-22)25-9-2-4-14-33(25)42-34)41-30-12-3-1-10-28(30)36-32(41)17-16-27-26-11-5-8-24(21-40)37(26)43-38(27)36;39-20-23-7-5-11-25(22-15-18-34-30(19-22)26-9-2-4-14-33(26)42-34)36(23)41-31-13-3-1-10-29(31)35-32(41)17-16-28-27-12-6-8-24(21-40)37(27)43-38(28)35;39-20-22-12-15-32(29(18-22)23-13-17-35-30(19-23)25-7-2-4-11-34(25)42-35)41-31-10-3-1-8-28(31)36-33(41)16-14-27-26-9-5-6-24(21-40)37(26)43-38(27)36;39-20-22-12-14-25(23-13-17-35-30(19-23)26-7-2-4-11-34(26)42-35)33(18-22)41-31-10-3-1-8-29(31)36-32(41)16-15-28-27-9-5-6-24(21-40)37(27)43-38(28)36/h4*1-19H
InChIKeyKLKDQCJGXPLYFB-UHFFFAOYSA-N
MW2262.63 g/mol
LogP41.85
Rot. Bonds8

About 5-(2-cyano-6-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(3-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(4-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(5-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile

5-(2-cyano-6-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(3-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(4-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(5-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile (PubChem CID 159168684) has the molecular formula C152H76N12O4S4 and a molecular weight of 2262.63 g/mol. Its IUPAC name is 5-(2-cyano-6-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(3-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(4-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(5-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile.

Molecular Properties

Compound Name5-(2-cyano-6-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(3-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(4-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(5-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile
PubChem CID159168684
Molecular FormulaC152H76N12O4S4
Molecular Weight2262.63 g/mol
Exact Mass2260.50
IUPAC Name5-(2-cyano-6-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(3-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(4-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(5-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile
SMILESN#Cc1ccc(-c2ccc3oc4ccccc4c3c2)c(-n2c3ccccc3c3c4sc5c(C#N)cccc5c4ccc32)c1.N#Cc1ccc(-n2c3ccccc3c3c4sc5c(C#N)cccc5c4ccc32)c(-c2ccc3oc4ccccc4c3c2)c1.N#Cc1cccc(-c2ccc3oc4ccccc4c3c2)c1-n1c2ccccc2c2c3sc4c(C#N)cccc4c3ccc21.N#Cc1cccc(-n2c3ccccc3c3c4sc5c(C#N)cccc5c4ccc32)c1-c1ccc2oc3ccccc3c2c1
InChIInChI=1S/4C38H19N3OS/c39-20-23-7-6-13-31(35(23)22-15-18-34-29(19-22)25-9-2-4-14-33(25)42-34)41-30-12-3-1-10-28(30)36-32(41)17-16-27-26-11-5-8-24(21-40)37(26)43-38(27)36;39-20-23-7-5-11-25(22-15-18-34-30(19-22)26-9-2-4-14-33(26)42-34)36(23)41-31-13-3-1-10-29(31)35-32(41)17-16-28-27-12-6-8-24(21-40)37(27)43-38(28)35;39-20-22-12-15-32(29(18-22)23-13-17-35-30(19-23)25-7-2-4-11-34(25)42-35)41-31-10-3-1-8-28(31)36-33(41)16-14-27-26-9-5-6-24(21-40)37(26)43-38(27)36;39-20-22-12-14-25(23-13-17-35-30(19-23)26-7-2-4-11-34(26)42-35)33(18-22)41-31-10-3-1-8-29(31)36-32(41)16-15-28-27-9-5-6-24(21-40)37(27)43-38(28)36/h4*1-19H
InChIKeyKLKDQCJGXPLYFB-UHFFFAOYSA-N
XLogP41.85
TPSA262.60 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds8
Heavy Atoms172
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002262.63
LogP ≤ 541.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Analyze 5-(2-cyano-6-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(3-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(4-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(5-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile with MolForge

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Related Compounds

2-carbazol-9-yl-3-dibenzofuran-2-ylbenzonitrile;3-carbazol-9-yl-2-dibenzofuran-2-ylbenzonitrile;3-carbazol-9-yl-4-dibenzofuran-2-ylbenzonitrile;4-carbazol-9-yl-3-dibenzofuran-2-ylbenzonitrile
CID 158041549
8-[2-([1]benzofuro[3,2-c]carbazol-5-yl)-3-cyanophenyl]dibenzofuran-2-carbonitrile;8-[2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-cyanophenyl]dibenzofuran-2-carbonitrile;8-[2-([1]benzofuro[3,2-c]carbazol-5-yl)-5-cyanophenyl]dibenzofuran-2-carbonitrile;5-(3-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzofuro[3,2-c]carbazole-11-carbonitrile
CID 161253648
2-carbazol-9-yl-3-dibenzofuran-3-ylbenzonitrile;3-carbazol-9-yl-2-dibenzofuran-3-ylbenzonitrile;3-carbazol-9-yl-4-dibenzofuran-3-ylbenzonitrile;4-carbazol-9-yl-3-dibenzofuran-3-ylbenzonitrile
CID 161435826
8-[2-([1]benzothiolo[3,2-c]carbazol-5-yl)-3-cyanophenyl]dibenzofuran-2-carbonitrile
CID 126577735
8-[2-([1]benzofuro[2,3-a]carbazol-12-yl)-6-cyanophenyl]dibenzofuran-2-carbonitrile;2-([1]benzofuro[2,3-a]carbazol-12-yl)-3-dibenzofuran-2-ylbenzonitrile;3-([1]benzofuro[2,3-a]carbazol-12-yl)-4-dibenzofuran-2-ylbenzonitrile;8-[2-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]dibenzofuran-2-carbonitrile
CID 160750863
8-(2-carbazol-9-yl-3-cyanophenyl)dibenzothiophene-2-carbonitrile;8-(2-carbazol-9-yl-4-cyanophenyl)dibenzothiophene-2-carbonitrile;8-(2-carbazol-9-yl-5-cyanophenyl)dibenzothiophene-2-carbonitrile;8-(2-carbazol-9-yl-6-cyanophenyl)dibenzothiophene-2-carbonitrile;7-(2-carbazol-9-ylphenyl)dibenzothiophene-3-carbonitrile
CID 163831971
3-carbazol-9-yl-2-(2-cyano-4-dibenzofuran-2-ylphenyl)benzonitrile;3-carbazol-9-yl-4-(4-dibenzofuran-2-ylphenyl)benzene-1,2-dicarbonitrile;8-[4-(2-carbazol-9-ylphenyl)-2-cyanophenyl]dibenzofuran-2-carbonitrile;9-[2-cyano-6-(4-dibenzofuran-2-ylphenyl)phenyl]carbazole-3-carbonitrile
CID 165075968
2-carbazol-9-yl-3-(4-carbazol-9-ylphenyl)benzonitrile;2-carbazol-9-yl-5-(2-carbazol-9-ylphenyl)benzonitrile;3-carbazol-9-yl-2-(4-carbazol-9-ylphenyl)benzonitrile;3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)benzonitrile;4-carbazol-9-yl-3-(4-carbazol-9-ylphenyl)benzonitrile
CID 165099700
2-carbazol-9-yl-3-(2-dibenzofuran-2-ylphenyl)benzonitrile;4-carbazol-9-yl-3-(2-dibenzofuran-2-ylphenyl)benzonitrile;2-carbazol-9-yl-3-[4-(9-phenylcarbazol-1-yl)phenyl]benzonitrile;3-(2-carbazol-9-ylphenyl)-2-dibenzofuran-2-ylbenzonitrile;3-(2-carbazol-9-ylphenyl)-4-dibenzofuran-2-ylbenzonitrile
CID 158132666
8-[2-(2-carbazol-9-yl-3-cyanophenyl)-6-cyanophenyl]dibenzofuran-2-carbonitrile;2-carbazol-9-yl-3-(2-dibenzofuran-2-yl-3-fluorophenyl)benzonitrile;3-carbazol-9-yl-4-(2-dibenzofuran-2-ylphenyl)benzene-1,2-dicarbonitrile;2-carbazol-9-yl-3-(2-dibenzofuran-3-ylphenyl)benzonitrile;4-carbazol-9-yl-3-(2-dibenzofuran-3-ylphenyl)benzonitrile;8-[2-(2-carbazol-9-ylphenyl)-6-cyanophenyl]dibenzofuran-2-carbonitrile
CID 165025646
6-[4-(1-cyanocarbazol-9-yl)-3-dibenzofuran-2-ylphenyl]-9-(2-dibenzofuran-2-ylphenyl)carbazole-2-carbonitrile
CID 167006192
9-[4-(2-carbazol-9-yl-5-cyanophenyl)phenyl]carbazole-3-carbonitrile;9-[4-(2-carbazol-9-yl-6-cyanophenyl)phenyl]carbazole-3-carbonitrile;9-[4-(2-carbazol-9-ylphenyl)-2-cyanophenyl]carbazole-3-carbonitrile;9-[4-(2-carbazol-9-ylphenyl)-3-cyanophenyl]carbazole-3-carbonitrile;9-[2-cyano-4-[2-(3-cyanocarbazol-9-yl)phenyl]phenyl]carbazole-3-carbonitrile;9-[3-cyano-4-[2-(3-cyanocarbazol-9-yl)phenyl]phenyl]carbazole-3-carbonitrile;9-[4-[2-cyano-6-(3-cyanocarbazol-9-yl)phenyl]phenyl]carbazole-3-carbonitrile;9-[4-[3-cyano-2-(3-cyanocarbazol-9-yl)phenyl]phenyl]carbazole-3-carbonitrile;9-[4-[4-cyano-2-(3-cyanocarbazol-9-yl)phenyl]phenyl]carbazole-3-carbonitrile;9-[4-[5-cyano-2-(3-cyanocarbazol-9-yl)phenyl]phenyl]carbazole-3-carbonitrile
CID 159914512

Frequently Asked Questions

What is the IUPAC name of 5-(2-cyano-6-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(3-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(4-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(5-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile?
The IUPAC name of 5-(2-cyano-6-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(3-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(4-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(5-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile (CID 159168684) is 5-(2-cyano-6-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(3-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(4-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(5-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile.
What is the SMILES notation for 5-(2-cyano-6-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(3-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(4-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(5-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile?
The canonical SMILES for 5-(2-cyano-6-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(3-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(4-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(5-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile is N#Cc1ccc(-c2ccc3oc4ccccc4c3c2)c(-n2c3ccccc3c3c4sc5c(C#N)cccc5c4ccc32)c1.N#Cc1ccc(-n2c3ccccc3c3c4sc5c(C#N)cccc5c4ccc32)c(-c2ccc3oc4ccccc4c3c2)c1.N#Cc1cccc(-c2ccc3oc4ccccc4c3c2)c1-n1c2ccccc2c2c3sc4c(C#N)cccc4c3ccc21.N#Cc1cccc(-n2c3ccccc3c3c4sc5c(C#N)cccc5c4ccc32)c1-c1ccc2oc3ccccc3c2c1.
What is the InChIKey of 5-(2-cyano-6-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(3-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(4-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(5-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile?
The InChIKey is KLKDQCJGXPLYFB-UHFFFAOYSA-N. The full InChI is InChI=1S/4C38H19N3OS/c39-20-23-7-6-13-31(35(23)22-15-18-34-29(19-22)25-9-2-4-14-33(25)42-34)41-30-12-3-1-10-28(30)36-32(41)17-16-27-26-11-5-8-24(21-40)37(26)43-38(27)36;39-20-23-7-5-11-25(22-15-18-34-30(19-22)26-9-2-4-14-33(26)42-34)36(23)41-31-13-3-1-10-29(31)35-32(41)17-16-28-27-12-6-8-24(21-40)37(27)43-38(28)35;39-20-22-12-15-32(29(18-22)23-13-17-35-30(19-23)25-7-2-4-11-34(25)42-35)41-31-10-3-1-8-28(31)36-33(41)16-14-27-26-9-5-6-24(21-40)37(26)43-38(27)36;39-20-22-12-14-25(23-13-17-35-30(19-23)26-7-2-4-11-34(26)42-35)33(18-22)41-31-10-3-1-8-29(31)36-32(41)16-15-28-27-9-5-6-24(21-40)37(27)43-38(28)36/h4*1-19H.
What are the key properties of 5-(2-cyano-6-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(3-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(4-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(5-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile?
5-(2-cyano-6-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(3-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(4-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(5-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile has a molecular weight of 2262.63 g/mol, XLogP of 41.85, 8 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-cyano-6-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(3-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(4-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile;5-(5-cyano-2-dibenzofuran-2-ylphenyl)-[1]benzothiolo[3,2-c]carbazole-11-carbonitrile is sourced from PubChem (CID 159168684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).