9-[2-(2-carbazol-9-ylphenyl)phenyl]-3-methylcarbazole

C37H26N2 — CID 170201849

IUPAC9-[2-(2-carbazol-9-ylphenyl)phenyl]-3-methylcarbazole
SMILESCc1ccc2c(c1)c1ccccc1n2-c1ccccc1-c1ccccc1-n1c2ccccc2c2ccccc21
InChIInChI=1S/C37H26N2/c1-25-22-23-37-31(24-25)30-16-6-11-21-36(30)39(37)35-20-10-5-15-29(35)28-14-4-9-19-34(28)38-32-17-7-2-12-26(32)27-13-3-8-18-33(27)38/h2-24H,1H3
InChIKeyCQHDGUQBDZIAAC-UHFFFAOYSA-N
MW498.63 g/mol
LogP9.86
Rot. Bonds3

About 9-[2-(2-carbazol-9-ylphenyl)phenyl]-3-methylcarbazole

9-[2-(2-carbazol-9-ylphenyl)phenyl]-3-methylcarbazole (PubChem CID 170201849) has the molecular formula C37H26N2 and a molecular weight of 498.63 g/mol. Its IUPAC name is 9-[2-(2-carbazol-9-ylphenyl)phenyl]-3-methylcarbazole.

Molecular Properties

Compound Name9-[2-(2-carbazol-9-ylphenyl)phenyl]-3-methylcarbazole
PubChem CID170201849
Molecular FormulaC37H26N2
Molecular Weight498.63 g/mol
Exact Mass498.21
IUPAC Name9-[2-(2-carbazol-9-ylphenyl)phenyl]-3-methylcarbazole
SMILESCc1ccc2c(c1)c1ccccc1n2-c1ccccc1-c1ccccc1-n1c2ccccc2c2ccccc21
InChIInChI=1S/C37H26N2/c1-25-22-23-37-31(24-25)30-16-6-11-21-36(30)39(37)35-20-10-5-15-29(35)28-14-4-9-19-34(28)38-32-17-7-2-12-26(32)27-13-3-8-18-33(27)38/h2-24H,1H3
InChIKeyCQHDGUQBDZIAAC-UHFFFAOYSA-N
XLogP9.86
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms39
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500498.63
LogP ≤ 59.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,6-dimethyl-9-[2-[2-(3-methylcarbazol-9-yl)phenyl]phenyl]carbazole
CID 170060425
3-methyl-9-[2-(3-methylcarbazol-9-yl)phenyl]carbazole
CID 58771355
[9-[2-[2-[3-(3-methylcarbazol-9-yl)carbazol-9-yl]phenyl]phenyl]carbazol-3-yl]-triphenylsilane
CID 174139185
9-[2-(2-carbazol-9-ylphenyl)phenyl]-3,6-diisocyanocarbazole
CID 159275273
3-(2-carbazol-9-ylphenyl)-9-(2-methylphenyl)carbazole
CID 164986167
9-[2-(2-methylphenyl)phenyl]-3-phenylcarbazole
CID 170070142
9-[4,6-bis(3-methylcarbazol-9-yl)-1,3,5-triazin-2-yl]-3-methylcarbazole
CID 155367112
3-methyl-9-[3-(3-methylcarbazol-9-yl)phenyl]carbazole
CID 59399075
9-[2-(2,6-dimethylpyrimidin-4-yl)-4-[2-(3-methylcarbazol-9-yl)phenyl]phenyl]-3-methylcarbazole
CID 158390729
9-[2-(6,16-dimethyl-8,14-dioxa-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaen-11-yl)phenyl]-3-methylcarbazole
CID 174181982
9-dibenzothiophen-4-yl-3-methylcarbazole
CID 90224671
3-methyl-9-oxidocarbazole
CID 166517305

Frequently Asked Questions

What is the IUPAC name of 9-[2-(2-carbazol-9-ylphenyl)phenyl]-3-methylcarbazole?
The IUPAC name of 9-[2-(2-carbazol-9-ylphenyl)phenyl]-3-methylcarbazole (CID 170201849) is 9-[2-(2-carbazol-9-ylphenyl)phenyl]-3-methylcarbazole.
What is the SMILES notation for 9-[2-(2-carbazol-9-ylphenyl)phenyl]-3-methylcarbazole?
The canonical SMILES for 9-[2-(2-carbazol-9-ylphenyl)phenyl]-3-methylcarbazole is Cc1ccc2c(c1)c1ccccc1n2-c1ccccc1-c1ccccc1-n1c2ccccc2c2ccccc21.
What is the InChIKey of 9-[2-(2-carbazol-9-ylphenyl)phenyl]-3-methylcarbazole?
The InChIKey is CQHDGUQBDZIAAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H26N2/c1-25-22-23-37-31(24-25)30-16-6-11-21-36(30)39(37)35-20-10-5-15-29(35)28-14-4-9-19-34(28)38-32-17-7-2-12-26(32)27-13-3-8-18-33(27)38/h2-24H,1H3.
What are the key properties of 9-[2-(2-carbazol-9-ylphenyl)phenyl]-3-methylcarbazole?
9-[2-(2-carbazol-9-ylphenyl)phenyl]-3-methylcarbazole has a molecular weight of 498.63 g/mol, XLogP of 9.86, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2-(2-carbazol-9-ylphenyl)phenyl]-3-methylcarbazole is sourced from PubChem (CID 170201849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).