benzene;3-(9-methylcarbazol-3-yl)-9-phenyl-6-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-1-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-2-(9-phenylcarbazol-2-yl)carbazole;9-methyl-5-(9-phenylcarbazol-2-yl)-3-(9-phenylcarbazol-3-yl)carbazole

C202H138N12 — CID 160731182

IUPACbenzene;3-(9-methylcarbazol-3-yl)-9-phenyl-6-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-1-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-2-(9-phenylcarbazol-2-yl)carbazole;9-methyl-5-(9-phenylcarbazol-2-yl)-3-(9-phenylcarbazol-3-yl)carbazole
SMILESCn1c2ccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2c2c(-c3ccc4c5ccccc5n(-c5ccccc5)c4c3)cccc21.Cn1c2ccccc2c2cc(-c3ccc4c(c3)c3cc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)ccc3n4-c3ccccc3)ccc21.Cn1c2ccccc2c2cc(-c3ccc4c(c3)c3ccc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)cc3n4-c3ccccc3)ccc21.Cn1c2ccccc2c2cc(-c3ccc4c(c3)c3cccc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)c3n4-c3ccccc3)ccc21.c1ccccc1
InChIInChI=1S/4C49H33N3.C6H6/c1-50-44-21-10-8-18-39(44)42-29-32(24-27-45(42)50)33-25-28-47-43(30-33)41-20-12-19-37(49(41)52(47)36-15-6-3-7-16-36)34-23-26-40-38-17-9-11-22-46(38)51(48(40)31-34)35-13-4-2-5-14-35;1-50-43-27-24-33(32-25-28-46-41(29-32)39-18-9-11-21-45(39)51(46)35-13-4-2-5-14-35)30-42(43)49-37(19-12-22-47(49)50)34-23-26-40-38-17-8-10-20-44(38)52(48(40)31-34)36-15-6-3-7-16-36;1-50-44-18-10-8-17-39(44)42-28-32(22-26-45(42)50)33-23-27-47-43(29-33)41-25-21-35(31-49(41)52(47)37-14-6-3-7-15-37)34-20-24-40-38-16-9-11-19-46(38)51(48(40)30-34)36-12-4-2-5-13-36;1-50-44-18-10-8-17-39(44)41-28-32(21-25-45(41)50)33-22-26-47-42(29-33)43-30-34(23-27-48(43)51(47)36-12-4-2-5-13-36)35-20-24-40-38-16-9-11-19-46(38)52(49(40)31-35)37-14-6-3-7-15-37;1-2-4-6-5-3-1/h4*2-31H,1H3;1-6H
InChIKeyRUIYYBGCZAGUEX-UHFFFAOYSA-N
MW2733.41 g/mol
LogP53.13
Rot. Bonds16

About benzene;3-(9-methylcarbazol-3-yl)-9-phenyl-6-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-1-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-2-(9-phenylcarbazol-2-yl)carbazole;9-methyl-5-(9-phenylcarbazol-2-yl)-3-(9-phenylcarbazol-3-yl)carbazole

benzene;3-(9-methylcarbazol-3-yl)-9-phenyl-6-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-1-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-2-(9-phenylcarbazol-2-yl)carbazole;9-methyl-5-(9-phenylcarbazol-2-yl)-3-(9-phenylcarbazol-3-yl)carbazole (PubChem CID 160731182) has the molecular formula C202H138N12 and a molecular weight of 2733.41 g/mol. Its IUPAC name is benzene;3-(9-methylcarbazol-3-yl)-9-phenyl-6-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-1-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-2-(9-phenylcarbazol-2-yl)carbazole;9-methyl-5-(9-phenylcarbazol-2-yl)-3-(9-phenylcarbazol-3-yl)carbazole.

Molecular Properties

Compound Namebenzene;3-(9-methylcarbazol-3-yl)-9-phenyl-6-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-1-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-2-(9-phenylcarbazol-2-yl)carbazole;9-methyl-5-(9-phenylcarbazol-2-yl)-3-(9-phenylcarbazol-3-yl)carbazole
PubChem CID160731182
Molecular FormulaC202H138N12
Molecular Weight2733.41 g/mol
Exact Mass2731.12
IUPAC Namebenzene;3-(9-methylcarbazol-3-yl)-9-phenyl-6-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-1-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-2-(9-phenylcarbazol-2-yl)carbazole;9-methyl-5-(9-phenylcarbazol-2-yl)-3-(9-phenylcarbazol-3-yl)carbazole
SMILESCn1c2ccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2c2c(-c3ccc4c5ccccc5n(-c5ccccc5)c4c3)cccc21.Cn1c2ccccc2c2cc(-c3ccc4c(c3)c3cc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)ccc3n4-c3ccccc3)ccc21.Cn1c2ccccc2c2cc(-c3ccc4c(c3)c3ccc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)cc3n4-c3ccccc3)ccc21.Cn1c2ccccc2c2cc(-c3ccc4c(c3)c3cccc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)c3n4-c3ccccc3)ccc21.c1ccccc1
InChIInChI=1S/4C49H33N3.C6H6/c1-50-44-21-10-8-18-39(44)42-29-32(24-27-45(42)50)33-25-28-47-43(30-33)41-20-12-19-37(49(41)52(47)36-15-6-3-7-16-36)34-23-26-40-38-17-9-11-22-46(38)51(48(40)31-34)35-13-4-2-5-14-35;1-50-43-27-24-33(32-25-28-46-41(29-32)39-18-9-11-21-45(39)51(46)35-13-4-2-5-14-35)30-42(43)49-37(19-12-22-47(49)50)34-23-26-40-38-17-8-10-20-44(38)52(48(40)31-34)36-15-6-3-7-16-36;1-50-44-18-10-8-17-39(44)42-28-32(22-26-45(42)50)33-23-27-47-43(29-33)41-25-21-35(31-49(41)52(47)37-14-6-3-7-15-37)34-20-24-40-38-16-9-11-19-46(38)51(48(40)30-34)36-12-4-2-5-13-36;1-50-44-18-10-8-17-39(44)41-28-32(21-25-45(41)50)33-22-26-47-42(29-33)43-30-34(23-27-48(43)51(47)36-12-4-2-5-13-36)35-20-24-40-38-16-9-11-19-46(38)52(49(40)31-35)37-14-6-3-7-15-37;1-2-4-6-5-3-1/h4*2-31H,1H3;1-6H
InChIKeyRUIYYBGCZAGUEX-UHFFFAOYSA-N
XLogP53.13
TPSA59.16 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds16
Heavy Atoms214
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002733.41
LogP ≤ 553.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze benzene;3-(9-methylcarbazol-3-yl)-9-phenyl-6-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-1-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-2-(9-phenylcarbazol-2-yl)carbazole;9-methyl-5-(9-phenylcarbazol-2-yl)-3-(9-phenylcarbazol-3-yl)carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of benzene;3-(9-methylcarbazol-3-yl)-9-phenyl-6-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-1-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-2-(9-phenylcarbazol-2-yl)carbazole;9-methyl-5-(9-phenylcarbazol-2-yl)-3-(9-phenylcarbazol-3-yl)carbazole?
The IUPAC name of benzene;3-(9-methylcarbazol-3-yl)-9-phenyl-6-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-1-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-2-(9-phenylcarbazol-2-yl)carbazole;9-methyl-5-(9-phenylcarbazol-2-yl)-3-(9-phenylcarbazol-3-yl)carbazole (CID 160731182) is benzene;3-(9-methylcarbazol-3-yl)-9-phenyl-6-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-1-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-2-(9-phenylcarbazol-2-yl)carbazole;9-methyl-5-(9-phenylcarbazol-2-yl)-3-(9-phenylcarbazol-3-yl)carbazole.
What is the SMILES notation for benzene;3-(9-methylcarbazol-3-yl)-9-phenyl-6-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-1-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-2-(9-phenylcarbazol-2-yl)carbazole;9-methyl-5-(9-phenylcarbazol-2-yl)-3-(9-phenylcarbazol-3-yl)carbazole?
The canonical SMILES for benzene;3-(9-methylcarbazol-3-yl)-9-phenyl-6-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-1-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-2-(9-phenylcarbazol-2-yl)carbazole;9-methyl-5-(9-phenylcarbazol-2-yl)-3-(9-phenylcarbazol-3-yl)carbazole is Cn1c2ccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2c2c(-c3ccc4c5ccccc5n(-c5ccccc5)c4c3)cccc21.Cn1c2ccccc2c2cc(-c3ccc4c(c3)c3cc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)ccc3n4-c3ccccc3)ccc21.Cn1c2ccccc2c2cc(-c3ccc4c(c3)c3ccc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)cc3n4-c3ccccc3)ccc21.Cn1c2ccccc2c2cc(-c3ccc4c(c3)c3cccc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)c3n4-c3ccccc3)ccc21.c1ccccc1.
What is the InChIKey of benzene;3-(9-methylcarbazol-3-yl)-9-phenyl-6-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-1-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-2-(9-phenylcarbazol-2-yl)carbazole;9-methyl-5-(9-phenylcarbazol-2-yl)-3-(9-phenylcarbazol-3-yl)carbazole?
The InChIKey is RUIYYBGCZAGUEX-UHFFFAOYSA-N. The full InChI is InChI=1S/4C49H33N3.C6H6/c1-50-44-21-10-8-18-39(44)42-29-32(24-27-45(42)50)33-25-28-47-43(30-33)41-20-12-19-37(49(41)52(47)36-15-6-3-7-16-36)34-23-26-40-38-17-9-11-22-46(38)51(48(40)31-34)35-13-4-2-5-14-35;1-50-43-27-24-33(32-25-28-46-41(29-32)39-18-9-11-21-45(39)51(46)35-13-4-2-5-14-35)30-42(43)49-37(19-12-22-47(49)50)34-23-26-40-38-17-8-10-20-44(38)52(48(40)31-34)36-15-6-3-7-16-36;1-50-44-18-10-8-17-39(44)42-28-32(22-26-45(42)50)33-23-27-47-43(29-33)41-25-21-35(31-49(41)52(47)37-14-6-3-7-15-37)34-20-24-40-38-16-9-11-19-46(38)51(48(40)30-34)36-12-4-2-5-13-36;1-50-44-18-10-8-17-39(44)41-28-32(21-25-45(41)50)33-22-26-47-42(29-33)43-30-34(23-27-48(43)51(47)36-12-4-2-5-13-36)35-20-24-40-38-16-9-11-19-46(38)52(49(40)31-35)37-14-6-3-7-15-37;1-2-4-6-5-3-1/h4*2-31H,1H3;1-6H.
What are the key properties of benzene;3-(9-methylcarbazol-3-yl)-9-phenyl-6-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-1-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-2-(9-phenylcarbazol-2-yl)carbazole;9-methyl-5-(9-phenylcarbazol-2-yl)-3-(9-phenylcarbazol-3-yl)carbazole?
benzene;3-(9-methylcarbazol-3-yl)-9-phenyl-6-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-1-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-2-(9-phenylcarbazol-2-yl)carbazole;9-methyl-5-(9-phenylcarbazol-2-yl)-3-(9-phenylcarbazol-3-yl)carbazole has a molecular weight of 2733.41 g/mol, XLogP of 53.13, 16 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;3-(9-methylcarbazol-3-yl)-9-phenyl-6-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-1-(9-phenylcarbazol-2-yl)carbazole;6-(9-methylcarbazol-3-yl)-9-phenyl-2-(9-phenylcarbazol-2-yl)carbazole;9-methyl-5-(9-phenylcarbazol-2-yl)-3-(9-phenylcarbazol-3-yl)carbazole is sourced from PubChem (CID 160731182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).