2-methyl-6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;2-methyl-7-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole-3-carbonitrile

C147H99N7 — CID 160584678

IUPAC2-methyl-6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;2-methyl-7-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole-3-carbonitrile
SMILESCc1ccc2c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)ccc3n(-c3cccc(-c4ccc(-c5ccccc5)cc4)c3)c2c1.Cc1ccc2c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3n(-c3cccc(-c4ccc(-c5ccccc5)cc4)c3)c2c1.N#Cc1ccc2c(c1)c1cc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)ccc1n2-c1cccc(-c2ccc(-c3ccccc3)cc2)c1
InChIInChI=1S/C49H31N3.2C49H34N2/c50-32-33-18-25-47-43(28-33)45-31-39(38-23-26-48-44(30-38)42-16-7-8-17-46(42)51(48)40-13-5-2-6-14-40)24-27-49(45)52(47)41-15-9-12-37(29-41)36-21-19-35(20-22-36)34-10-3-1-4-11-34;1-33-19-26-43-44-27-24-39(38-25-28-47-45(31-38)42-17-8-9-18-46(42)50(47)40-14-6-3-7-15-40)32-49(44)51(48(43)29-33)41-16-10-13-37(30-41)36-22-20-35(21-23-36)34-11-4-2-5-12-34;1-33-19-26-43-45-32-39(38-24-27-47-44(31-38)42-17-8-9-18-46(42)50(47)40-14-6-3-7-15-40)25-28-48(45)51(49(43)29-33)41-16-10-13-37(30-41)36-22-20-35(21-23-36)34-11-4-2-5-12-34/h1-31H;2*2-32H,1H3
InChIKeyRCFWKHJXDUWGCB-UHFFFAOYSA-N
MW1963.46 g/mol
LogP39.13
Rot. Bonds15

About 2-methyl-6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;2-methyl-7-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole-3-carbonitrile

2-methyl-6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;2-methyl-7-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole-3-carbonitrile (PubChem CID 160584678) has the molecular formula C147H99N7 and a molecular weight of 1963.46 g/mol. Its IUPAC name is 2-methyl-6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;2-methyl-7-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole-3-carbonitrile.

Molecular Properties

Compound Name2-methyl-6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;2-methyl-7-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole-3-carbonitrile
PubChem CID160584678
Molecular FormulaC147H99N7
Molecular Weight1963.46 g/mol
Exact Mass1961.80
IUPAC Name2-methyl-6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;2-methyl-7-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole-3-carbonitrile
SMILESCc1ccc2c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)ccc3n(-c3cccc(-c4ccc(-c5ccccc5)cc4)c3)c2c1.Cc1ccc2c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3n(-c3cccc(-c4ccc(-c5ccccc5)cc4)c3)c2c1.N#Cc1ccc2c(c1)c1cc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)ccc1n2-c1cccc(-c2ccc(-c3ccccc3)cc2)c1
InChIInChI=1S/C49H31N3.2C49H34N2/c50-32-33-18-25-47-43(28-33)45-31-39(38-23-26-48-44(30-38)42-16-7-8-17-46(42)51(48)40-13-5-2-6-14-40)24-27-49(45)52(47)41-15-9-12-37(29-41)36-21-19-35(20-22-36)34-10-3-1-4-11-34;1-33-19-26-43-44-27-24-39(38-25-28-47-45(31-38)42-17-8-9-18-46(42)50(47)40-14-6-3-7-15-40)32-49(44)51(48(43)29-33)41-16-10-13-37(30-41)36-22-20-35(21-23-36)34-11-4-2-5-12-34;1-33-19-26-43-45-32-39(38-24-27-47-44(31-38)42-17-8-9-18-46(42)50(47)40-14-6-3-7-15-40)25-28-48(45)51(49(43)29-33)41-16-10-13-37(30-41)36-22-20-35(21-23-36)34-11-4-2-5-12-34/h1-31H;2*2-32H,1H3
InChIKeyRCFWKHJXDUWGCB-UHFFFAOYSA-N
XLogP39.13
TPSA53.37 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds15
Heavy Atoms154
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001963.46
LogP ≤ 539.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 2-methyl-6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;2-methyl-7-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole-3-carbonitrile with MolForge

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Related Compounds

3-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-6,9-diphenylcarbazole;9-phenyl-6-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole-3-carbonitrile
CID 159170044
4-[4-[2-[9-(4-methylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]benzonitrile
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4-[4-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]benzonitrile
CID 126747004
6-(4-carbazol-9-ylphenyl)-9-phenylcarbazole-2-carbonitrile
CID 126690271
4-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]benzonitrile;3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]benzonitrile;4-[3-[3-(9-triphenylen-2-ylcarbazol-3-yl)carbazol-9-yl]phenyl]benzonitrile;4-[4-[3-(9-triphenylen-2-ylcarbazol-3-yl)carbazol-9-yl]phenyl]benzonitrile
CID 157150513
9-[3-[3-(3-cyanophenyl)phenyl]-5-(9-phenylcarbazol-3-yl)phenyl]carbazole-3-carbonitrile
CID 126610493
6-(9-phenylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole-2-carbonitrile;6-(9-phenylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole-3-carbonitrile;triphenyl-[6-(9-phenylcarbazol-3-yl)-9-(3-phenylphenyl)carbazol-2-yl]silane;triphenyl-[6-(9-phenylcarbazol-3-yl)-9-(3-phenylphenyl)carbazol-3-yl]silane
CID 159693921
4-[4-[2-[9-(4-cyanophenyl)carbazol-3-yl]carbazol-9-yl]phenyl]benzonitrile
CID 153301946
2-(9-phenylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole;3-(9-phenylcarbazol-2-yl)-9-(3-phenylphenyl)carbazole;3-(9-phenylcarbazol-2-yl)-9-(4-phenylphenyl)carbazole;9-(4-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 162164191
2-phenyl-9-[4-[9-(3-phenylphenyl)carbazol-3-yl]phenyl]carbazole;2-phenyl-9-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]carbazole;3-phenyl-9-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 165078172
9-(3-phenylphenyl)-2-[4-[9-(3-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 165386227
9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]carbazole-3-carbonitrile
CID 118650216

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;2-methyl-7-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole-3-carbonitrile?
The IUPAC name of 2-methyl-6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;2-methyl-7-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole-3-carbonitrile (CID 160584678) is 2-methyl-6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;2-methyl-7-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole-3-carbonitrile.
What is the SMILES notation for 2-methyl-6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;2-methyl-7-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole-3-carbonitrile?
The canonical SMILES for 2-methyl-6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;2-methyl-7-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole-3-carbonitrile is Cc1ccc2c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)ccc3n(-c3cccc(-c4ccc(-c5ccccc5)cc4)c3)c2c1.Cc1ccc2c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3n(-c3cccc(-c4ccc(-c5ccccc5)cc4)c3)c2c1.N#Cc1ccc2c(c1)c1cc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)ccc1n2-c1cccc(-c2ccc(-c3ccccc3)cc2)c1.
What is the InChIKey of 2-methyl-6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;2-methyl-7-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole-3-carbonitrile?
The InChIKey is RCFWKHJXDUWGCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H31N3.2C49H34N2/c50-32-33-18-25-47-43(28-33)45-31-39(38-23-26-48-44(30-38)42-16-7-8-17-46(42)51(48)40-13-5-2-6-14-40)24-27-49(45)52(47)41-15-9-12-37(29-41)36-21-19-35(20-22-36)34-10-3-1-4-11-34;1-33-19-26-43-44-27-24-39(38-25-28-47-45(31-38)42-17-8-9-18-46(42)50(47)40-14-6-3-7-15-40)32-49(44)51(48(43)29-33)41-16-10-13-37(30-41)36-22-20-35(21-23-36)34-11-4-2-5-12-34;1-33-19-26-43-45-32-39(38-24-27-47-44(31-38)42-17-8-9-18-46(42)50(47)40-14-6-3-7-15-40)25-28-48(45)51(49(43)29-33)41-16-10-13-37(30-41)36-22-20-35(21-23-36)34-11-4-2-5-12-34/h1-31H;2*2-32H,1H3.
What are the key properties of 2-methyl-6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;2-methyl-7-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole-3-carbonitrile?
2-methyl-6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;2-methyl-7-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole-3-carbonitrile has a molecular weight of 1963.46 g/mol, XLogP of 39.13, 15 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;2-methyl-7-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole-3-carbonitrile is sourced from PubChem (CID 160584678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).