4-carbazol-9-yl-6-[3-(3-cyanocarbazol-9-yl)-5-phenylphenyl]benzene-1,3-dicarbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-2-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(5-carbazol-9-yl-2-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3,6-dicarbonitrile

C181H99N21 — CID 161414501

IUPAC4-carbazol-9-yl-6-[3-(3-cyanocarbazol-9-yl)-5-phenylphenyl]benzene-1,3-dicarbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-2-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(5-carbazol-9-yl-2-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3,6-dicarbonitrile
SMILESN#Cc1cc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4cc(C#N)ccc43)c2C#N)cc(-n2c3ccccc3c3ccccc32)c1.N#Cc1cc(-c2cc(-n3c4ccc(C#N)cc4c4cc(C#N)ccc43)cc(-c3ccccc3)c2C#N)cc(-n2c3ccccc3c3ccccc32)c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1cc(-c2ccccc2)c(C#N)c(-c2cc(-n3c4ccccc4c4ccccc43)ccc2C#N)c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1cc(-c2ccccc2)cc(-c2cc(-n3c4ccccc4c4ccccc43)c(C#N)cc2C#N)c1
InChIInChI=1S/C46H24N6.3C45H25N5/c47-25-29-14-16-45-40(20-29)41-21-30(26-48)15-17-46(41)52(45)35-23-38(32-8-2-1-3-9-32)42(28-50)39(24-35)33-18-31(27-49)19-34(22-33)51-43-12-6-4-10-36(43)37-11-5-7-13-44(37)51;46-26-29-18-19-44-40(20-29)38-14-6-7-15-41(38)49(44)35-23-31(30-10-2-1-3-11-30)21-32(24-35)39-25-45(34(28-48)22-33(39)27-47)50-42-16-8-4-12-36(42)37-13-5-9-17-43(37)50;46-26-29-18-21-45-40(22-29)36-14-6-9-17-44(36)50(45)33-24-37(30-10-2-1-3-11-30)41(28-48)39(25-33)38-23-32(20-19-31(38)27-47)49-42-15-7-4-12-34(42)35-13-5-8-16-43(35)49;46-26-29-18-19-44-39(22-29)37-14-6-9-17-43(37)50(44)45-25-32(31-10-2-1-3-11-31)24-38(40(45)28-48)33-20-30(27-47)21-34(23-33)49-41-15-7-4-12-35(41)36-13-5-8-16-42(36)49/h1-24H;3*1-25H
InChIKeyVVXBUGVFUTXOSB-UHFFFAOYSA-N
MW2567.93 g/mol
LogP43.19
Rot. Bonds16

About 4-carbazol-9-yl-6-[3-(3-cyanocarbazol-9-yl)-5-phenylphenyl]benzene-1,3-dicarbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-2-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(5-carbazol-9-yl-2-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3,6-dicarbonitrile

4-carbazol-9-yl-6-[3-(3-cyanocarbazol-9-yl)-5-phenylphenyl]benzene-1,3-dicarbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-2-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(5-carbazol-9-yl-2-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3,6-dicarbonitrile (PubChem CID 161414501) has the molecular formula C181H99N21 and a molecular weight of 2567.93 g/mol. Its IUPAC name is 4-carbazol-9-yl-6-[3-(3-cyanocarbazol-9-yl)-5-phenylphenyl]benzene-1,3-dicarbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-2-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(5-carbazol-9-yl-2-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3,6-dicarbonitrile.

Molecular Properties

Compound Name4-carbazol-9-yl-6-[3-(3-cyanocarbazol-9-yl)-5-phenylphenyl]benzene-1,3-dicarbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-2-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(5-carbazol-9-yl-2-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3,6-dicarbonitrile
PubChem CID161414501
Molecular FormulaC181H99N21
Molecular Weight2567.93 g/mol
Exact Mass2565.84
IUPAC Name4-carbazol-9-yl-6-[3-(3-cyanocarbazol-9-yl)-5-phenylphenyl]benzene-1,3-dicarbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-2-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(5-carbazol-9-yl-2-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3,6-dicarbonitrile
SMILESN#Cc1cc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4cc(C#N)ccc43)c2C#N)cc(-n2c3ccccc3c3ccccc32)c1.N#Cc1cc(-c2cc(-n3c4ccc(C#N)cc4c4cc(C#N)ccc43)cc(-c3ccccc3)c2C#N)cc(-n2c3ccccc3c3ccccc32)c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1cc(-c2ccccc2)c(C#N)c(-c2cc(-n3c4ccccc4c4ccccc43)ccc2C#N)c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1cc(-c2ccccc2)cc(-c2cc(-n3c4ccccc4c4ccccc43)c(C#N)cc2C#N)c1
InChIInChI=1S/C46H24N6.3C45H25N5/c47-25-29-14-16-45-40(20-29)41-21-30(26-48)15-17-46(41)52(45)35-23-38(32-8-2-1-3-9-32)42(28-50)39(24-35)33-18-31(27-49)19-34(22-33)51-43-12-6-4-10-36(43)37-11-5-7-13-44(37)51;46-26-29-18-19-44-40(20-29)38-14-6-7-15-41(38)49(44)35-23-31(30-10-2-1-3-11-30)21-32(24-35)39-25-45(34(28-48)22-33(39)27-47)50-42-16-8-4-12-36(42)37-13-5-9-17-43(37)50;46-26-29-18-21-45-40(22-29)36-14-6-9-17-44(36)50(45)33-24-37(30-10-2-1-3-11-30)41(28-48)39(25-33)38-23-32(20-19-31(38)27-47)49-42-15-7-4-12-34(42)35-13-5-8-16-43(35)49;46-26-29-18-19-44-39(22-29)37-14-6-9-17-43(37)50(44)45-25-32(31-10-2-1-3-11-31)24-38(40(45)28-48)33-20-30(27-47)21-34(23-33)49-41-15-7-4-12-35(41)36-13-5-8-16-42(36)49/h1-24H;3*1-25H
InChIKeyVVXBUGVFUTXOSB-UHFFFAOYSA-N
XLogP43.19
TPSA348.71 Ų
H-Bond Donors
H-Bond Acceptors21
Rotatable Bonds16
Heavy Atoms202
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002567.93
LogP ≤ 543.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1021

Analyze 4-carbazol-9-yl-6-[3-(3-cyanocarbazol-9-yl)-5-phenylphenyl]benzene-1,3-dicarbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-2-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(5-carbazol-9-yl-2-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3,6-dicarbonitrile with MolForge

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Related Compounds

3-carbazol-9-yl-5-[3-carbazol-9-yl-5-(3-cyanophenyl)phenyl]benzonitrile;2-[3-carbazol-9-yl-5-(3-carbazol-9-ylphenyl)phenyl]benzonitrile;2-carbazol-9-yl-4-(3-carbazol-9-yl-5-phenylphenyl)benzonitrile;2-carbazol-9-yl-6-(3-carbazol-9-yl-5-phenylphenyl)benzonitrile
CID 164973443
2-carbazol-9-yl-6-(3-carbazol-9-ylphenyl)-4-phenylbenzonitrile;3-carbazol-9-yl-5-(3-carbazol-9-yl-5-phenylphenyl)benzonitrile;4-carbazol-9-yl-2-(3-carbazol-9-ylphenyl)-6-phenylbenzonitrile;9-[3-(5-carbazol-9-yl-2-isocyanophenyl)-5-phenylphenyl]carbazole
CID 158343073
9-[3-(3-carbazol-9-yl-5-cyanophenyl)-5-(2-cyanophenyl)phenyl]carbazole-3-carbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-5-(3-cyanophenyl)phenyl]carbazole-3-carbonitrile;9-[3-(3-carbazol-9-yl-2-cyanophenyl)-5-phenylphenyl]carbazole-2-carbonitrile;9-[3-(3-carbazol-9-yl-4-cyanophenyl)-5-phenylphenyl]carbazole-1-carbonitrile
CID 165012311
9-[4-[3-(2-carbazol-9-ylphenyl)-5-cyanophenyl]-3-cyanophenyl]carbazole-3-carbonitrile
CID 155080959
9-[4-[5-(2-carbazol-9-ylphenyl)-2-cyanophenyl]phenyl]carbazole-3-carbonitrile
CID 155079728
9-[2-[3-(4-carbazol-9-ylphenyl)-4-cyanophenyl]phenyl]carbazole-3-carbonitrile
CID 155081345
2-(3-carbazol-9-yl-5-cyanophenyl)-4-(2-carbazol-9-ylphenyl)benzonitrile
CID 155081382
5-(2-carbazol-9-ylphenyl)-3-[3-(3-cyanocarbazol-9-yl)phenyl]benzene-1,2-dicarbonitrile
CID 155081736
9-[3-cyano-5-(2-cyano-3-phenylphenyl)phenyl]carbazole-3,6-dicarbonitrile
CID 126761643
9-[3-[4-(2-carbazol-9-ylphenyl)-2-cyanophenyl]-5-cyanophenyl]carbazole-3,6-dicarbonitrile
CID 155081007
2-[4-(3-carbazol-9-ylcarbazol-9-yl)-2,6-diphenylphenyl]benzene-1,4-dicarbonitrile
CID 140903234
9-[3-[2-(2-carbazol-9-ylphenyl)phenyl]-5-cyanophenyl]carbazole-3,6-dicarbonitrile
CID 155081651

Frequently Asked Questions

What is the IUPAC name of 4-carbazol-9-yl-6-[3-(3-cyanocarbazol-9-yl)-5-phenylphenyl]benzene-1,3-dicarbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-2-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(5-carbazol-9-yl-2-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3,6-dicarbonitrile?
The IUPAC name of 4-carbazol-9-yl-6-[3-(3-cyanocarbazol-9-yl)-5-phenylphenyl]benzene-1,3-dicarbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-2-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(5-carbazol-9-yl-2-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3,6-dicarbonitrile (CID 161414501) is 4-carbazol-9-yl-6-[3-(3-cyanocarbazol-9-yl)-5-phenylphenyl]benzene-1,3-dicarbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-2-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(5-carbazol-9-yl-2-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3,6-dicarbonitrile.
What is the SMILES notation for 4-carbazol-9-yl-6-[3-(3-cyanocarbazol-9-yl)-5-phenylphenyl]benzene-1,3-dicarbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-2-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(5-carbazol-9-yl-2-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3,6-dicarbonitrile?
The canonical SMILES for 4-carbazol-9-yl-6-[3-(3-cyanocarbazol-9-yl)-5-phenylphenyl]benzene-1,3-dicarbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-2-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(5-carbazol-9-yl-2-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3,6-dicarbonitrile is N#Cc1cc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4cc(C#N)ccc43)c2C#N)cc(-n2c3ccccc3c3ccccc32)c1.N#Cc1cc(-c2cc(-n3c4ccc(C#N)cc4c4cc(C#N)ccc43)cc(-c3ccccc3)c2C#N)cc(-n2c3ccccc3c3ccccc32)c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1cc(-c2ccccc2)c(C#N)c(-c2cc(-n3c4ccccc4c4ccccc43)ccc2C#N)c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1cc(-c2ccccc2)cc(-c2cc(-n3c4ccccc4c4ccccc43)c(C#N)cc2C#N)c1.
What is the InChIKey of 4-carbazol-9-yl-6-[3-(3-cyanocarbazol-9-yl)-5-phenylphenyl]benzene-1,3-dicarbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-2-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(5-carbazol-9-yl-2-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3,6-dicarbonitrile?
The InChIKey is VVXBUGVFUTXOSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H24N6.3C45H25N5/c47-25-29-14-16-45-40(20-29)41-21-30(26-48)15-17-46(41)52(45)35-23-38(32-8-2-1-3-9-32)42(28-50)39(24-35)33-18-31(27-49)19-34(22-33)51-43-12-6-4-10-36(43)37-11-5-7-13-44(37)51;46-26-29-18-19-44-40(20-29)38-14-6-7-15-41(38)49(44)35-23-31(30-10-2-1-3-11-30)21-32(24-35)39-25-45(34(28-48)22-33(39)27-47)50-42-16-8-4-12-36(42)37-13-5-9-17-43(37)50;46-26-29-18-21-45-40(22-29)36-14-6-9-17-44(36)50(45)33-24-37(30-10-2-1-3-11-30)41(28-48)39(25-33)38-23-32(20-19-31(38)27-47)49-42-15-7-4-12-34(42)35-13-5-8-16-43(35)49;46-26-29-18-19-44-39(22-29)37-14-6-9-17-43(37)50(44)45-25-32(31-10-2-1-3-11-31)24-38(40(45)28-48)33-20-30(27-47)21-34(23-33)49-41-15-7-4-12-35(41)36-13-5-8-16-42(36)49/h1-24H;3*1-25H.
What are the key properties of 4-carbazol-9-yl-6-[3-(3-cyanocarbazol-9-yl)-5-phenylphenyl]benzene-1,3-dicarbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-2-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(5-carbazol-9-yl-2-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3,6-dicarbonitrile?
4-carbazol-9-yl-6-[3-(3-cyanocarbazol-9-yl)-5-phenylphenyl]benzene-1,3-dicarbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-2-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(5-carbazol-9-yl-2-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3,6-dicarbonitrile has a molecular weight of 2567.93 g/mol, XLogP of 43.19, 16 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 4-carbazol-9-yl-6-[3-(3-cyanocarbazol-9-yl)-5-phenylphenyl]benzene-1,3-dicarbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-2-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(5-carbazol-9-yl-2-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3-carbonitrile;9-[3-(3-carbazol-9-yl-5-cyanophenyl)-4-cyano-5-phenylphenyl]carbazole-3,6-dicarbonitrile is sourced from PubChem (CID 161414501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).