9-(2,4-dimethylphenyl)-2-[9-(2,4-dimethylphenyl)carbazol-2-yl]carbazole

C40H32N2 — CID 59935132

IUPAC9-(2,4-dimethylphenyl)-2-[9-(2,4-dimethylphenyl)carbazol-2-yl]carbazole
SMILESCc1ccc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6n(-c6ccc(C)cc6C)c5c4)cc32)c(C)c1
InChIInChI=1S/C40H32N2/c1-25-13-19-35(27(3)21-25)41-37-11-7-5-9-31(37)33-17-15-29(23-39(33)41)30-16-18-34-32-10-6-8-12-38(32)42(40(34)24-30)36-20-14-26(2)22-28(36)4/h5-24H,1-4H3
InChIKeyIOWCXRKPRJNCKI-UHFFFAOYSA-N
MW540.71 g/mol
LogP10.78
Rot. Bonds3

About 9-(2,4-dimethylphenyl)-2-[9-(2,4-dimethylphenyl)carbazol-2-yl]carbazole

9-(2,4-dimethylphenyl)-2-[9-(2,4-dimethylphenyl)carbazol-2-yl]carbazole (PubChem CID 59935132) has the molecular formula C40H32N2 and a molecular weight of 540.71 g/mol. Its IUPAC name is 9-(2,4-dimethylphenyl)-2-[9-(2,4-dimethylphenyl)carbazol-2-yl]carbazole.

Molecular Properties

Compound Name9-(2,4-dimethylphenyl)-2-[9-(2,4-dimethylphenyl)carbazol-2-yl]carbazole
PubChem CID59935132
Molecular FormulaC40H32N2
Molecular Weight540.71 g/mol
Exact Mass540.26
IUPAC Name9-(2,4-dimethylphenyl)-2-[9-(2,4-dimethylphenyl)carbazol-2-yl]carbazole
SMILESCc1ccc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6n(-c6ccc(C)cc6C)c5c4)cc32)c(C)c1
InChIInChI=1S/C40H32N2/c1-25-13-19-35(27(3)21-25)41-37-11-7-5-9-31(37)33-17-15-29(23-39(33)41)30-16-18-34-32-10-6-8-12-38(32)42(40(34)24-30)36-20-14-26(2)22-28(36)4/h5-24H,1-4H3
InChIKeyIOWCXRKPRJNCKI-UHFFFAOYSA-N
XLogP10.78
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500540.71
LogP ≤ 510.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-(2-methyl-4-phenylphenyl)carbazole
CID 143868574
9-(2,4-dimethylphenyl)-1,3-dimethylcarbazole
CID 146638363
9-[4-[4-[4-[4-(4-carbazol-9-yl-3-methylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole
CID 59742225
2-[9-(4-methylphenyl)carbazol-3-yl]-9-phenylcarbazole
CID 135248578
3-methyl-9-[2-(3-methylcarbazol-9-yl)phenyl]carbazole
CID 58771355
9-[2,4-bis(2,6-diphenylpyrimidin-4-yl)phenyl]-2-(2,4-dimethylphenyl)carbazole
CID 137421078
3-methyl-9-(4-methylphenyl)-6-[9-(4-methylphenyl)-6-[9-(4-methylphenyl)carbazol-3-yl]carbazol-3-yl]carbazole
CID 70866701
9-[4-carbazol-9-yl-2-(4-methylphenyl)phenyl]carbazole
CID 59742176
6-methyl-2-(9-phenylcarbazol-3-yl)-9-triphenylen-2-ylcarbazole
CID 118330173
2-methyl-9-phenylcarbazole
CID 59552741
4-[3,5-bis[2,7-bis(4-methylphenyl)carbazol-9-yl]-4-pyridinyl]benzonitrile;4-[3,5-bis[2-(2,4-dimethylphenyl)carbazol-9-yl]-4-pyridinyl]benzonitrile;4-[3,5-bis[2-(4-methylphenyl)carbazol-9-yl]-4-pyridinyl]benzonitrile
CID 160846267
3-methyl-9-(2-methylphenyl)-6-[9-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-yl]carbazole;3-methyl-9-(4-methylphenyl)-6-[9-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-yl]carbazole;3-[9-(2-methylphenyl)carbazol-3-yl]-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole;3-[9-(4-methylphenyl)carbazol-3-yl]-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole
CID 161215741

Frequently Asked Questions

What is the IUPAC name of 9-(2,4-dimethylphenyl)-2-[9-(2,4-dimethylphenyl)carbazol-2-yl]carbazole?
The IUPAC name of 9-(2,4-dimethylphenyl)-2-[9-(2,4-dimethylphenyl)carbazol-2-yl]carbazole (CID 59935132) is 9-(2,4-dimethylphenyl)-2-[9-(2,4-dimethylphenyl)carbazol-2-yl]carbazole.
What is the SMILES notation for 9-(2,4-dimethylphenyl)-2-[9-(2,4-dimethylphenyl)carbazol-2-yl]carbazole?
The canonical SMILES for 9-(2,4-dimethylphenyl)-2-[9-(2,4-dimethylphenyl)carbazol-2-yl]carbazole is Cc1ccc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6n(-c6ccc(C)cc6C)c5c4)cc32)c(C)c1.
What is the InChIKey of 9-(2,4-dimethylphenyl)-2-[9-(2,4-dimethylphenyl)carbazol-2-yl]carbazole?
The InChIKey is IOWCXRKPRJNCKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H32N2/c1-25-13-19-35(27(3)21-25)41-37-11-7-5-9-31(37)33-17-15-29(23-39(33)41)30-16-18-34-32-10-6-8-12-38(32)42(40(34)24-30)36-20-14-26(2)22-28(36)4/h5-24H,1-4H3.
What are the key properties of 9-(2,4-dimethylphenyl)-2-[9-(2,4-dimethylphenyl)carbazol-2-yl]carbazole?
9-(2,4-dimethylphenyl)-2-[9-(2,4-dimethylphenyl)carbazol-2-yl]carbazole has a molecular weight of 540.71 g/mol, XLogP of 10.78, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2,4-dimethylphenyl)-2-[9-(2,4-dimethylphenyl)carbazol-2-yl]carbazole is sourced from PubChem (CID 59935132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).