9-(9-dibenzothiophen-1-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-2-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-3-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-4-yldibenzofuran-4-yl)-3,6-dimethylcarbazole

C149H85N7O4S4 — CID 160666840

IUPAC9-(9-dibenzothiophen-1-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-2-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-3-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-4-yldibenzofuran-4-yl)-3,6-dimethylcarbazole
SMILESCc1ccc2c(c1)c1cc(C)ccc1n2-c1cccc2c1oc1cccc(-c3cccc4c3sc3ccccc34)c12.N#Cc1ccc2c3ccccc3n(-c3cccc4c3oc3cccc(-c5ccc6c(c5)sc5ccccc56)c34)c2c1.N#Cc1ccc2c3ccccc3n(-c3cccc4c3oc3cccc(-c5ccc6sc7ccccc7c6c5)c34)c2c1.N#Cc1ccc2c3ccccc3n(-c3cccc4c3oc3cccc(-c5cccc6sc7ccccc7c56)c34)c2c1
InChIInChI=1S/C38H25NOS.3C37H20N2OS/c1-22-16-18-31-29(20-22)30-21-23(2)17-19-32(30)39(31)33-13-6-12-28-36-25(9-7-14-34(36)40-37(28)33)27-11-5-10-26-24-8-3-4-15-35(24)41-38(26)27;38-21-22-18-19-24-23-8-1-3-13-29(23)39(31(24)20-22)30-14-5-12-28-35-25(10-6-15-32(35)40-37(28)30)26-11-7-17-34-36(26)27-9-2-4-16-33(27)41-34;38-21-22-15-17-26-25-7-1-3-11-30(25)39(32(26)19-22)31-12-5-10-29-36-24(9-6-13-33(36)40-37(29)31)23-16-18-28-27-8-2-4-14-34(27)41-35(28)20-23;38-21-22-15-17-26-25-7-1-3-11-30(25)39(32(26)19-22)31-12-5-10-28-36-24(9-6-13-33(36)40-37(28)31)23-16-18-35-29(20-23)27-8-2-4-14-34(27)41-35/h3-21H,1-2H3;3*1-20H
InChIKeyRMKKYDKHIKUOEM-UHFFFAOYSA-N
MW2165.63 g/mol
LogP43.10
Rot. Bonds8

About 9-(9-dibenzothiophen-1-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-2-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-3-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-4-yldibenzofuran-4-yl)-3,6-dimethylcarbazole

9-(9-dibenzothiophen-1-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-2-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-3-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-4-yldibenzofuran-4-yl)-3,6-dimethylcarbazole (PubChem CID 160666840) has the molecular formula C149H85N7O4S4 and a molecular weight of 2165.63 g/mol. Its IUPAC name is 9-(9-dibenzothiophen-1-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-2-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-3-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-4-yldibenzofuran-4-yl)-3,6-dimethylcarbazole.

Molecular Properties

Compound Name9-(9-dibenzothiophen-1-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-2-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-3-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-4-yldibenzofuran-4-yl)-3,6-dimethylcarbazole
PubChem CID160666840
Molecular FormulaC149H85N7O4S4
Molecular Weight2165.63 g/mol
Exact Mass2163.55
IUPAC Name9-(9-dibenzothiophen-1-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-2-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-3-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-4-yldibenzofuran-4-yl)-3,6-dimethylcarbazole
SMILESCc1ccc2c(c1)c1cc(C)ccc1n2-c1cccc2c1oc1cccc(-c3cccc4c3sc3ccccc34)c12.N#Cc1ccc2c3ccccc3n(-c3cccc4c3oc3cccc(-c5ccc6c(c5)sc5ccccc56)c34)c2c1.N#Cc1ccc2c3ccccc3n(-c3cccc4c3oc3cccc(-c5ccc6sc7ccccc7c6c5)c34)c2c1.N#Cc1ccc2c3ccccc3n(-c3cccc4c3oc3cccc(-c5cccc6sc7ccccc7c56)c34)c2c1
InChIInChI=1S/C38H25NOS.3C37H20N2OS/c1-22-16-18-31-29(20-22)30-21-23(2)17-19-32(30)39(31)33-13-6-12-28-36-25(9-7-14-34(36)40-37(28)33)27-11-5-10-26-24-8-3-4-15-35(24)41-38(26)27;38-21-22-18-19-24-23-8-1-3-13-29(23)39(31(24)20-22)30-14-5-12-28-35-25(10-6-15-32(35)40-37(28)30)26-11-7-17-34-36(26)27-9-2-4-16-33(27)41-34;38-21-22-15-17-26-25-7-1-3-11-30(25)39(32(26)19-22)31-12-5-10-29-36-24(9-6-13-33(36)40-37(29)31)23-16-18-28-27-8-2-4-14-34(27)41-35(28)20-23;38-21-22-15-17-26-25-7-1-3-11-30(25)39(32(26)19-22)31-12-5-10-28-36-24(9-6-13-33(36)40-37(28)31)23-16-18-35-29(20-23)27-8-2-4-14-34(27)41-35/h3-21H,1-2H3;3*1-20H
InChIKeyRMKKYDKHIKUOEM-UHFFFAOYSA-N
XLogP43.10
TPSA143.65 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds8
Heavy Atoms164
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002165.63
LogP ≤ 543.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 9-(9-dibenzothiophen-1-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-2-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-3-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-4-yldibenzofuran-4-yl)-3,6-dimethylcarbazole with MolForge

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Related Compounds

9-(9-dibenzothiophen-1-yldibenzothiophen-4-yl)carbazole-3-carbonitrile;9-(9-dibenzothiophen-2-yldibenzothiophen-4-yl)carbazole-3-carbonitrile;9-(9-dibenzothiophen-3-yldibenzothiophen-4-yl)carbazole-3-carbonitrile;9-(9-dibenzothiophen-4-yldibenzothiophen-4-yl)-2-phenylcarbazole
CID 161330058
9-(9-dibenzothiophen-3-yldibenzothiophen-4-yl)carbazole-2-carbonitrile
CID 153168563
9-(8-dibenzothiophen-4-yldibenzofuran-4-yl)carbazole-3-carbonitrile
CID 147349483
9-(9-dibenzothiophen-1-yl-6-phenyldibenzothiophen-4-yl)-3,6-dimethylcarbazole;9-(9-dibenzothiophen-1-yl-6-phenyldibenzothiophen-4-yl)-3,6-diphenylcarbazole;9-(9-dibenzothiophen-2-yl-6-phenyldibenzothiophen-4-yl)-3,6-diphenylcarbazole;9-(9-dibenzothiophen-3-yl-6-phenyldibenzothiophen-4-yl)-3,6-diphenylcarbazole;9-(9-dibenzothiophen-4-yl-6-phenyldibenzothiophen-4-yl)-3,6-diphenylcarbazole
CID 159688864
9-(9-dibenzofuran-2-yldibenzofuran-4-yl)carbazole-2-carbonitrile
CID 149138143
9-(8-dibenzothiophen-1-yldibenzothiophen-4-yl)carbazole;9-(8-dibenzothiophen-2-yldibenzothiophen-4-yl)carbazole;9-(8-dibenzothiophen-3-yldibenzothiophen-4-yl)carbazole;9-(8-dibenzothiophen-4-yldibenzothiophen-4-yl)carbazole
CID 162055088
9-(8-dibenzofuran-1-yldibenzothiophen-4-yl)carbazole-3-carbonitrile;9-(8-dibenzofuran-2-yldibenzothiophen-4-yl)carbazole-3-carbonitrile;9-(8-dibenzofuran-3-yldibenzothiophen-4-yl)-2-phenylcarbazole;9-(8-dibenzofuran-4-yldibenzothiophen-4-yl)-2-phenylcarbazole
CID 158620921
9-(8-dibenzothiophen-1-yl-6-phenyldibenzofuran-4-yl)-3-phenylcarbazole;9-(8-dibenzothiophen-2-yl-6-phenyldibenzofuran-4-yl)-3-phenylcarbazole;9-(8-dibenzothiophen-3-yl-6-phenyldibenzofuran-4-yl)-3-phenylcarbazole;9-(8-dibenzothiophen-4-yl-6-phenyldibenzofuran-4-yl)-3-phenylcarbazole
CID 157074673
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
1-dibenzothiophen-4-yl-6-(3-phenylcarbazol-9-yl)dibenzofuran-4-carbonitrile
CID 147581589
9-dibenzofuran-4-yl-6-dibenzothiophen-4-yl-2-phenylcarbazole
CID 163656757
9-(8-dibenzothiophen-2-yl-6-phenyldibenzofuran-4-yl)carbazole-2-carbonitrile
CID 147995432

Frequently Asked Questions

What is the IUPAC name of 9-(9-dibenzothiophen-1-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-2-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-3-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-4-yldibenzofuran-4-yl)-3,6-dimethylcarbazole?
The IUPAC name of 9-(9-dibenzothiophen-1-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-2-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-3-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-4-yldibenzofuran-4-yl)-3,6-dimethylcarbazole (CID 160666840) is 9-(9-dibenzothiophen-1-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-2-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-3-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-4-yldibenzofuran-4-yl)-3,6-dimethylcarbazole.
What is the SMILES notation for 9-(9-dibenzothiophen-1-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-2-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-3-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-4-yldibenzofuran-4-yl)-3,6-dimethylcarbazole?
The canonical SMILES for 9-(9-dibenzothiophen-1-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-2-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-3-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-4-yldibenzofuran-4-yl)-3,6-dimethylcarbazole is Cc1ccc2c(c1)c1cc(C)ccc1n2-c1cccc2c1oc1cccc(-c3cccc4c3sc3ccccc34)c12.N#Cc1ccc2c3ccccc3n(-c3cccc4c3oc3cccc(-c5ccc6c(c5)sc5ccccc56)c34)c2c1.N#Cc1ccc2c3ccccc3n(-c3cccc4c3oc3cccc(-c5ccc6sc7ccccc7c6c5)c34)c2c1.N#Cc1ccc2c3ccccc3n(-c3cccc4c3oc3cccc(-c5cccc6sc7ccccc7c56)c34)c2c1.
What is the InChIKey of 9-(9-dibenzothiophen-1-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-2-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-3-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-4-yldibenzofuran-4-yl)-3,6-dimethylcarbazole?
The InChIKey is RMKKYDKHIKUOEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H25NOS.3C37H20N2OS/c1-22-16-18-31-29(20-22)30-21-23(2)17-19-32(30)39(31)33-13-6-12-28-36-25(9-7-14-34(36)40-37(28)33)27-11-5-10-26-24-8-3-4-15-35(24)41-38(26)27;38-21-22-18-19-24-23-8-1-3-13-29(23)39(31(24)20-22)30-14-5-12-28-35-25(10-6-15-32(35)40-37(28)30)26-11-7-17-34-36(26)27-9-2-4-16-33(27)41-34;38-21-22-15-17-26-25-7-1-3-11-30(25)39(32(26)19-22)31-12-5-10-29-36-24(9-6-13-33(36)40-37(29)31)23-16-18-28-27-8-2-4-14-34(27)41-35(28)20-23;38-21-22-15-17-26-25-7-1-3-11-30(25)39(32(26)19-22)31-12-5-10-28-36-24(9-6-13-33(36)40-37(28)31)23-16-18-35-29(20-23)27-8-2-4-14-34(27)41-35/h3-21H,1-2H3;3*1-20H.
What are the key properties of 9-(9-dibenzothiophen-1-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-2-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-3-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-4-yldibenzofuran-4-yl)-3,6-dimethylcarbazole?
9-(9-dibenzothiophen-1-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-2-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-3-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-4-yldibenzofuran-4-yl)-3,6-dimethylcarbazole has a molecular weight of 2165.63 g/mol, XLogP of 43.10, 8 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(9-dibenzothiophen-1-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-2-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-3-yldibenzofuran-4-yl)carbazole-2-carbonitrile;9-(9-dibenzothiophen-4-yldibenzofuran-4-yl)-3,6-dimethylcarbazole is sourced from PubChem (CID 160666840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).