9-[4-[2-(2-cyanophenyl)phenyl]-6-pyrido[2,3-b]indol-9-yl-2-pyridinyl]carbazole-3,6-dicarbonitrile

C43H23N7 — CID 121312480

IUPAC9-[4-[2-(2-cyanophenyl)phenyl]-6-pyrido[2,3-b]indol-9-yl-2-pyridinyl]carbazole-3,6-dicarbonitrile
SMILESN#Cc1ccc2c(c1)c1cc(C#N)ccc1n2-c1cc(-c2ccccc2-c2ccccc2C#N)cc(-n2c3ccccc3c3cccnc32)n1
InChIInChI=1S/C43H23N7/c44-24-27-15-17-39-36(20-27)37-21-28(25-45)16-18-40(37)49(39)41-22-30(32-10-3-4-11-33(32)31-9-2-1-8-29(31)26-46)23-42(48-41)50-38-14-6-5-12-34(38)35-13-7-19-47-43(35)50/h1-23H
InChIKeyCEURCKFOSCJBNL-UHFFFAOYSA-N
MW637.71 g/mol
LogP9.62
Rot. Bonds4

About 9-[4-[2-(2-cyanophenyl)phenyl]-6-pyrido[2,3-b]indol-9-yl-2-pyridinyl]carbazole-3,6-dicarbonitrile

9-[4-[2-(2-cyanophenyl)phenyl]-6-pyrido[2,3-b]indol-9-yl-2-pyridinyl]carbazole-3,6-dicarbonitrile (PubChem CID 121312480) has the molecular formula C43H23N7 and a molecular weight of 637.71 g/mol. Its IUPAC name is 9-[4-[2-(2-cyanophenyl)phenyl]-6-pyrido[2,3-b]indol-9-yl-2-pyridinyl]carbazole-3,6-dicarbonitrile.

Molecular Properties

Compound Name9-[4-[2-(2-cyanophenyl)phenyl]-6-pyrido[2,3-b]indol-9-yl-2-pyridinyl]carbazole-3,6-dicarbonitrile
PubChem CID121312480
Molecular FormulaC43H23N7
Molecular Weight637.71 g/mol
Exact Mass637.20
IUPAC Name9-[4-[2-(2-cyanophenyl)phenyl]-6-pyrido[2,3-b]indol-9-yl-2-pyridinyl]carbazole-3,6-dicarbonitrile
SMILESN#Cc1ccc2c(c1)c1cc(C#N)ccc1n2-c1cc(-c2ccccc2-c2ccccc2C#N)cc(-n2c3ccccc3c3cccnc32)n1
InChIInChI=1S/C43H23N7/c44-24-27-15-17-39-36(20-27)37-21-28(25-45)16-18-40(37)49(39)41-22-30(32-10-3-4-11-33(32)31-9-2-1-8-29(31)26-46)23-42(48-41)50-38-14-6-5-12-34(38)35-13-7-19-47-43(35)50/h1-23H
InChIKeyCEURCKFOSCJBNL-UHFFFAOYSA-N
XLogP9.62
TPSA107.01 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500637.71
LogP ≤ 59.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

9-[4-[2-[2-(4-cyanophenyl)phenyl]phenyl]-6-pyrido[2,3-b]indol-9-yl-2-pyridinyl]carbazole-3,6-dicarbonitrile
CID 121312507
9-[6-carbazol-9-yl-4-(2-cyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile
CID 121312383
3-[2-[2-(2-carbazol-9-yl-6-pyrido[2,3-b]indol-9-yl-4-pyridinyl)phenyl]phenyl]benzonitrile
CID 121312443
9-[6-carbazol-9-yl-4-[2-(2-cyanophenyl)phenyl]-2-pyridinyl]carbazole-3-carbonitrile;9-[6-carbazol-9-yl-4-[2-(3-cyanophenyl)phenyl]-2-pyridinyl]carbazole-3-carbonitrile;9-[6-carbazol-9-yl-4-[2-(4-cyanophenyl)phenyl]-2-pyridinyl]carbazole-3-carbonitrile;9-[6-carbazol-9-yl-4-[2-(2-cyanophenyl)phenyl]-2-pyridinyl]carbazole-3,6-dicarbonitrile
CID 158469733
9-[6-carbazol-9-yl-4-[2-(4-cyanophenyl)phenyl]-2-pyridinyl]carbazole-3,6-dicarbonitrile
CID 121312324
9-[6-carbazol-9-yl-4-(2,4-dicyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile
CID 155179704
9-[3-carbazol-9-yl-5-[2-[2-[2-(4-cyanophenyl)phenyl]phenyl]phenyl]phenyl]carbazole-3,6-dicarbonitrile;2-[2-[2-[2,6-di(carbazol-9-yl)-4-pyridinyl]phenyl]phenyl]benzonitrile;3-[2-[2-[2,6-di(carbazol-9-yl)-4-pyridinyl]phenyl]phenyl]benzonitrile
CID 164964760
9-[6-carbazol-9-yl-4-(4-cyanophenyl)-2-pyridinyl]carbazole-3-carbonitrile;9-[6-carbazol-9-yl-4-(2-cyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile;9-[6-carbazol-9-yl-4-(3-cyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile;9-[6-carbazol-9-yl-4-(4-cyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile
CID 165039885
9-(6-carbazol-9-yl-2-pyridinyl)carbazole-3,6-dicarbonitrile
CID 118650226
9-[6-carbazol-9-yl-4-[3-(3-cyanophenyl)phenyl]-2-pyridinyl]carbazole-3,6-dicarbonitrile
CID 121312485
9-[3-[2-(4-cyano-3-pyridinyl)phenyl]phenyl]carbazole-3-carbonitrile
CID 146542671
9-[2-[2-(4-cyano-3-pyridinyl)phenyl]phenyl]carbazole-3-carbonitrile
CID 146542601

Frequently Asked Questions

What is the IUPAC name of 9-[4-[2-(2-cyanophenyl)phenyl]-6-pyrido[2,3-b]indol-9-yl-2-pyridinyl]carbazole-3,6-dicarbonitrile?
The IUPAC name of 9-[4-[2-(2-cyanophenyl)phenyl]-6-pyrido[2,3-b]indol-9-yl-2-pyridinyl]carbazole-3,6-dicarbonitrile (CID 121312480) is 9-[4-[2-(2-cyanophenyl)phenyl]-6-pyrido[2,3-b]indol-9-yl-2-pyridinyl]carbazole-3,6-dicarbonitrile.
What is the SMILES notation for 9-[4-[2-(2-cyanophenyl)phenyl]-6-pyrido[2,3-b]indol-9-yl-2-pyridinyl]carbazole-3,6-dicarbonitrile?
The canonical SMILES for 9-[4-[2-(2-cyanophenyl)phenyl]-6-pyrido[2,3-b]indol-9-yl-2-pyridinyl]carbazole-3,6-dicarbonitrile is N#Cc1ccc2c(c1)c1cc(C#N)ccc1n2-c1cc(-c2ccccc2-c2ccccc2C#N)cc(-n2c3ccccc3c3cccnc32)n1.
What is the InChIKey of 9-[4-[2-(2-cyanophenyl)phenyl]-6-pyrido[2,3-b]indol-9-yl-2-pyridinyl]carbazole-3,6-dicarbonitrile?
The InChIKey is CEURCKFOSCJBNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H23N7/c44-24-27-15-17-39-36(20-27)37-21-28(25-45)16-18-40(37)49(39)41-22-30(32-10-3-4-11-33(32)31-9-2-1-8-29(31)26-46)23-42(48-41)50-38-14-6-5-12-34(38)35-13-7-19-47-43(35)50/h1-23H.
What are the key properties of 9-[4-[2-(2-cyanophenyl)phenyl]-6-pyrido[2,3-b]indol-9-yl-2-pyridinyl]carbazole-3,6-dicarbonitrile?
9-[4-[2-(2-cyanophenyl)phenyl]-6-pyrido[2,3-b]indol-9-yl-2-pyridinyl]carbazole-3,6-dicarbonitrile has a molecular weight of 637.71 g/mol, XLogP of 9.62, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[2-(2-cyanophenyl)phenyl]-6-pyrido[2,3-b]indol-9-yl-2-pyridinyl]carbazole-3,6-dicarbonitrile is sourced from PubChem (CID 121312480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).