3-[3,6-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-[3-[6-[3-[9-[3-[2,7-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-cyano-2-(3-cyanophenyl)phenyl]-7-(2-phenyl-3-pyridinyl)carbazol-2-yl]-2-phenyl-4-pyridinyl]-2-phenyl-3-pyridinyl]-6-(2-phenyl-3-pyridinyl)carbazol-9-yl]-4-(3-cyanophenyl)benzonitrile

C164H98N16 — CID 146237901

IUPAC3-[3,6-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-[3-[6-[3-[9-[3-[2,7-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-cyano-2-(3-cyanophenyl)phenyl]-7-(2-phenyl-3-pyridinyl)carbazol-2-yl]-2-phenyl-4-pyridinyl]-2-phenyl-3-pyridinyl]-6-(2-phenyl-3-pyridinyl)carbazol-9-yl]-4-(3-cyanophenyl)benzonitrile
SMILESN#Cc1cccc(-c2c(-n3c4ccc(-c5cccnc5-c5ccccc5)cc4c4cc(-c5cccnc5-c5ccccc5)ccc43)cc(C#N)cc2-n2c3ccc(-c4cccnc4-c4ccccc4)cc3c3cc(-c4ccc(-c5ccnc(-c6ccccc6)c5-c5ccc6c7ccc(-c8cccnc8-c8ccccc8)cc7n(-c7cc(C#N)cc(-n8c9cc(-c%10cccnc%10-c%10ccccc%10)ccc9c9ccc(-c%10cccnc%10-c%10ccccc%10)cc98)c7-c7cccc(C#N)c7)c6c5)nc4-c4ccccc4)ccc32)c1
InChIInChI=1S/C164H98N16/c165-99-103-33-25-51-122(85-103)155-150(177-142-73-63-115(125-53-27-78-169-157(125)107-35-9-1-10-36-107)91-137(142)138-92-116(64-74-143(138)177)126-54-28-79-170-158(126)108-37-11-2-12-38-108)87-105(101-167)88-151(155)178-144-75-65-117(127-55-29-80-171-159(127)109-39-13-3-14-40-109)93-139(144)140-94-118(66-76-145(140)178)131-71-72-141(176-163(131)113-47-21-7-22-48-113)136-77-84-175-164(114-49-23-8-24-50-114)154(136)124-62-70-135-134-69-61-121(130-58-32-83-174-162(130)112-45-19-6-20-46-112)97-148(134)180(149(135)98-124)153-90-106(102-168)89-152(156(153)123-52-26-34-104(86-123)100-166)179-146-95-119(128-56-30-81-172-160(128)110-41-15-4-16-42-110)59-67-132(146)133-68-60-120(96-147(133)179)129-57-31-82-173-161(129)111-43-17-5-18-44-111/h1-98H
InChIKeyRIUYJYPRFOZKAY-UHFFFAOYSA-N
MW2292.70 g/mol
LogP40.39
Rot. Bonds23

About 3-[3,6-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-[3-[6-[3-[9-[3-[2,7-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-cyano-2-(3-cyanophenyl)phenyl]-7-(2-phenyl-3-pyridinyl)carbazol-2-yl]-2-phenyl-4-pyridinyl]-2-phenyl-3-pyridinyl]-6-(2-phenyl-3-pyridinyl)carbazol-9-yl]-4-(3-cyanophenyl)benzonitrile

3-[3,6-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-[3-[6-[3-[9-[3-[2,7-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-cyano-2-(3-cyanophenyl)phenyl]-7-(2-phenyl-3-pyridinyl)carbazol-2-yl]-2-phenyl-4-pyridinyl]-2-phenyl-3-pyridinyl]-6-(2-phenyl-3-pyridinyl)carbazol-9-yl]-4-(3-cyanophenyl)benzonitrile (PubChem CID 146237901) has the molecular formula C164H98N16 and a molecular weight of 2292.70 g/mol. Its IUPAC name is 3-[3,6-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-[3-[6-[3-[9-[3-[2,7-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-cyano-2-(3-cyanophenyl)phenyl]-7-(2-phenyl-3-pyridinyl)carbazol-2-yl]-2-phenyl-4-pyridinyl]-2-phenyl-3-pyridinyl]-6-(2-phenyl-3-pyridinyl)carbazol-9-yl]-4-(3-cyanophenyl)benzonitrile.

Molecular Properties

Compound Name3-[3,6-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-[3-[6-[3-[9-[3-[2,7-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-cyano-2-(3-cyanophenyl)phenyl]-7-(2-phenyl-3-pyridinyl)carbazol-2-yl]-2-phenyl-4-pyridinyl]-2-phenyl-3-pyridinyl]-6-(2-phenyl-3-pyridinyl)carbazol-9-yl]-4-(3-cyanophenyl)benzonitrile
PubChem CID146237901
Molecular FormulaC164H98N16
Molecular Weight2292.70 g/mol
Exact Mass2290.82
IUPAC Name3-[3,6-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-[3-[6-[3-[9-[3-[2,7-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-cyano-2-(3-cyanophenyl)phenyl]-7-(2-phenyl-3-pyridinyl)carbazol-2-yl]-2-phenyl-4-pyridinyl]-2-phenyl-3-pyridinyl]-6-(2-phenyl-3-pyridinyl)carbazol-9-yl]-4-(3-cyanophenyl)benzonitrile
SMILESN#Cc1cccc(-c2c(-n3c4ccc(-c5cccnc5-c5ccccc5)cc4c4cc(-c5cccnc5-c5ccccc5)ccc43)cc(C#N)cc2-n2c3ccc(-c4cccnc4-c4ccccc4)cc3c3cc(-c4ccc(-c5ccnc(-c6ccccc6)c5-c5ccc6c7ccc(-c8cccnc8-c8ccccc8)cc7n(-c7cc(C#N)cc(-n8c9cc(-c%10cccnc%10-c%10ccccc%10)ccc9c9ccc(-c%10cccnc%10-c%10ccccc%10)cc98)c7-c7cccc(C#N)c7)c6c5)nc4-c4ccccc4)ccc32)c1
InChIInChI=1S/C164H98N16/c165-99-103-33-25-51-122(85-103)155-150(177-142-73-63-115(125-53-27-78-169-157(125)107-35-9-1-10-36-107)91-137(142)138-92-116(64-74-143(138)177)126-54-28-79-170-158(126)108-37-11-2-12-38-108)87-105(101-167)88-151(155)178-144-75-65-117(127-55-29-80-171-159(127)109-39-13-3-14-40-109)93-139(144)140-94-118(66-76-145(140)178)131-71-72-141(176-163(131)113-47-21-7-22-48-113)136-77-84-175-164(114-49-23-8-24-50-114)154(136)124-62-70-135-134-69-61-121(130-58-32-83-174-162(130)112-45-19-6-20-46-112)97-148(134)180(149(135)98-124)153-90-106(102-168)89-152(156(153)123-52-26-34-104(86-123)100-166)179-146-95-119(128-56-30-81-172-160(128)110-41-15-4-16-42-110)59-67-132(146)133-68-60-120(96-147(133)179)129-57-31-82-173-161(129)111-43-17-5-18-44-111/h1-98H
InChIKeyRIUYJYPRFOZKAY-UHFFFAOYSA-N
XLogP40.39
TPSA218.00 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds23
Heavy Atoms180
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002292.70
LogP ≤ 540.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze 3-[3,6-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-[3-[6-[3-[9-[3-[2,7-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-cyano-2-(3-cyanophenyl)phenyl]-7-(2-phenyl-3-pyridinyl)carbazol-2-yl]-2-phenyl-4-pyridinyl]-2-phenyl-3-pyridinyl]-6-(2-phenyl-3-pyridinyl)carbazol-9-yl]-4-(3-cyanophenyl)benzonitrile with MolForge

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Related Compounds

3-[3,5-bis[3,6-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-4-pyridinyl]benzonitrile
CID 146544391
3,5-bis[2,7-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-4-[2,6-bis(trifluoromethyl)phenyl]benzonitrile
CID 162610621
4-[3,5-bis[2,7-bis(2-phenyl-4-pyridinyl)carbazol-9-yl]-4-pyridinyl]benzonitrile;4-[3,5-bis[3,6-bis(2-phenyl-4-pyridinyl)carbazol-9-yl]-4-pyridinyl]benzonitrile;4-[3,5-bis[2-(2-phenyl-3-pyridinyl)carbazol-9-yl]-4-pyridinyl]benzonitrile
CID 165071052
3-[3,5-bis[3-(2-phenyl-3-pyridinyl)carbazol-9-yl]-4-(trifluoromethyl)phenyl]benzonitrile
CID 155377672
3-[4,5-bis[3-(2-phenyl-3-pyridinyl)carbazol-9-yl]-2-(trifluoromethyl)phenyl]benzonitrile
CID 146984250
4-(3-cyanophenyl)-3,5-bis[3,6-di(pyrimidin-2-yl)carbazol-9-yl]benzonitrile
CID 142465963
3-carbazol-9-yl-4-(3-cyanophenyl)-5-[2-(2-cyanophenyl)carbazol-9-yl]benzonitrile
CID 142466016
4-(3-cyanophenyl)-3,5-bis[2-(2-cyanophenyl)carbazol-9-yl]benzonitrile
CID 146237957
4-[3,5-bis[3-(2-phenyl-3-pyridinyl)carbazol-9-yl]-4-pyridinyl]benzonitrile
CID 146544200
3,5-bis[3,6-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-(3-cyanophenyl)benzonitrile
CID 155377908
3,5-bis[3,6-bis(3-cyanophenyl)carbazol-9-yl]-4-(3-cyanophenyl)benzonitrile
CID 142465868
4-[9-[3-[2,7-bis(2,4-dicyanophenyl)carbazol-9-yl]-5-cyano-2-(3-cyanophenyl)phenyl]-7-(2,4-dicyanophenyl)carbazol-2-yl]benzene-1,3-dicarbonitrile
CID 146237996

Frequently Asked Questions

What is the IUPAC name of 3-[3,6-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-[3-[6-[3-[9-[3-[2,7-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-cyano-2-(3-cyanophenyl)phenyl]-7-(2-phenyl-3-pyridinyl)carbazol-2-yl]-2-phenyl-4-pyridinyl]-2-phenyl-3-pyridinyl]-6-(2-phenyl-3-pyridinyl)carbazol-9-yl]-4-(3-cyanophenyl)benzonitrile?
The IUPAC name of 3-[3,6-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-[3-[6-[3-[9-[3-[2,7-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-cyano-2-(3-cyanophenyl)phenyl]-7-(2-phenyl-3-pyridinyl)carbazol-2-yl]-2-phenyl-4-pyridinyl]-2-phenyl-3-pyridinyl]-6-(2-phenyl-3-pyridinyl)carbazol-9-yl]-4-(3-cyanophenyl)benzonitrile (CID 146237901) is 3-[3,6-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-[3-[6-[3-[9-[3-[2,7-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-cyano-2-(3-cyanophenyl)phenyl]-7-(2-phenyl-3-pyridinyl)carbazol-2-yl]-2-phenyl-4-pyridinyl]-2-phenyl-3-pyridinyl]-6-(2-phenyl-3-pyridinyl)carbazol-9-yl]-4-(3-cyanophenyl)benzonitrile.
What is the SMILES notation for 3-[3,6-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-[3-[6-[3-[9-[3-[2,7-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-cyano-2-(3-cyanophenyl)phenyl]-7-(2-phenyl-3-pyridinyl)carbazol-2-yl]-2-phenyl-4-pyridinyl]-2-phenyl-3-pyridinyl]-6-(2-phenyl-3-pyridinyl)carbazol-9-yl]-4-(3-cyanophenyl)benzonitrile?
The canonical SMILES for 3-[3,6-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-[3-[6-[3-[9-[3-[2,7-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-cyano-2-(3-cyanophenyl)phenyl]-7-(2-phenyl-3-pyridinyl)carbazol-2-yl]-2-phenyl-4-pyridinyl]-2-phenyl-3-pyridinyl]-6-(2-phenyl-3-pyridinyl)carbazol-9-yl]-4-(3-cyanophenyl)benzonitrile is N#Cc1cccc(-c2c(-n3c4ccc(-c5cccnc5-c5ccccc5)cc4c4cc(-c5cccnc5-c5ccccc5)ccc43)cc(C#N)cc2-n2c3ccc(-c4cccnc4-c4ccccc4)cc3c3cc(-c4ccc(-c5ccnc(-c6ccccc6)c5-c5ccc6c7ccc(-c8cccnc8-c8ccccc8)cc7n(-c7cc(C#N)cc(-n8c9cc(-c%10cccnc%10-c%10ccccc%10)ccc9c9ccc(-c%10cccnc%10-c%10ccccc%10)cc98)c7-c7cccc(C#N)c7)c6c5)nc4-c4ccccc4)ccc32)c1.
What is the InChIKey of 3-[3,6-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-[3-[6-[3-[9-[3-[2,7-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-cyano-2-(3-cyanophenyl)phenyl]-7-(2-phenyl-3-pyridinyl)carbazol-2-yl]-2-phenyl-4-pyridinyl]-2-phenyl-3-pyridinyl]-6-(2-phenyl-3-pyridinyl)carbazol-9-yl]-4-(3-cyanophenyl)benzonitrile?
The InChIKey is RIUYJYPRFOZKAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C164H98N16/c165-99-103-33-25-51-122(85-103)155-150(177-142-73-63-115(125-53-27-78-169-157(125)107-35-9-1-10-36-107)91-137(142)138-92-116(64-74-143(138)177)126-54-28-79-170-158(126)108-37-11-2-12-38-108)87-105(101-167)88-151(155)178-144-75-65-117(127-55-29-80-171-159(127)109-39-13-3-14-40-109)93-139(144)140-94-118(66-76-145(140)178)131-71-72-141(176-163(131)113-47-21-7-22-48-113)136-77-84-175-164(114-49-23-8-24-50-114)154(136)124-62-70-135-134-69-61-121(130-58-32-83-174-162(130)112-45-19-6-20-46-112)97-148(134)180(149(135)98-124)153-90-106(102-168)89-152(156(153)123-52-26-34-104(86-123)100-166)179-146-95-119(128-56-30-81-172-160(128)110-41-15-4-16-42-110)59-67-132(146)133-68-60-120(96-147(133)179)129-57-31-82-173-161(129)111-43-17-5-18-44-111/h1-98H.
What are the key properties of 3-[3,6-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-[3-[6-[3-[9-[3-[2,7-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-cyano-2-(3-cyanophenyl)phenyl]-7-(2-phenyl-3-pyridinyl)carbazol-2-yl]-2-phenyl-4-pyridinyl]-2-phenyl-3-pyridinyl]-6-(2-phenyl-3-pyridinyl)carbazol-9-yl]-4-(3-cyanophenyl)benzonitrile?
3-[3,6-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-[3-[6-[3-[9-[3-[2,7-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-cyano-2-(3-cyanophenyl)phenyl]-7-(2-phenyl-3-pyridinyl)carbazol-2-yl]-2-phenyl-4-pyridinyl]-2-phenyl-3-pyridinyl]-6-(2-phenyl-3-pyridinyl)carbazol-9-yl]-4-(3-cyanophenyl)benzonitrile has a molecular weight of 2292.70 g/mol, XLogP of 40.39, 23 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3,6-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-[3-[6-[3-[9-[3-[2,7-bis(2-phenyl-3-pyridinyl)carbazol-9-yl]-5-cyano-2-(3-cyanophenyl)phenyl]-7-(2-phenyl-3-pyridinyl)carbazol-2-yl]-2-phenyl-4-pyridinyl]-2-phenyl-3-pyridinyl]-6-(2-phenyl-3-pyridinyl)carbazol-9-yl]-4-(3-cyanophenyl)benzonitrile is sourced from PubChem (CID 146237901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).