3-carbazol-9-yl-6-(2,4,6-trimethylphenyl)-9H-carbazole

C33H26N2 — CID 146281218

IUPAC3-carbazol-9-yl-6-(2,4,6-trimethylphenyl)-9H-carbazole
SMILESCc1cc(C)c(-c2ccc3[nH]c4ccc(-n5c6ccccc6c6ccccc65)cc4c3c2)c(C)c1
InChIInChI=1S/C33H26N2/c1-20-16-21(2)33(22(3)17-20)23-12-14-29-27(18-23)28-19-24(13-15-30(28)34-29)35-31-10-6-4-8-25(31)26-9-5-7-11-32(26)35/h4-19,34H,1-3H3
InChIKeyWHZHVQQGOJJGDG-UHFFFAOYSA-N
MW450.59 g/mol
LogP9.01
Rot. Bonds2

About 3-carbazol-9-yl-6-(2,4,6-trimethylphenyl)-9H-carbazole

3-carbazol-9-yl-6-(2,4,6-trimethylphenyl)-9H-carbazole (PubChem CID 146281218) has the molecular formula C33H26N2 and a molecular weight of 450.59 g/mol. Its IUPAC name is 3-carbazol-9-yl-6-(2,4,6-trimethylphenyl)-9H-carbazole.

Molecular Properties

Compound Name3-carbazol-9-yl-6-(2,4,6-trimethylphenyl)-9H-carbazole
PubChem CID146281218
Molecular FormulaC33H26N2
Molecular Weight450.59 g/mol
Exact Mass450.21
IUPAC Name3-carbazol-9-yl-6-(2,4,6-trimethylphenyl)-9H-carbazole
SMILESCc1cc(C)c(-c2ccc3[nH]c4ccc(-n5c6ccccc6c6ccccc65)cc4c3c2)c(C)c1
InChIInChI=1S/C33H26N2/c1-20-16-21(2)33(22(3)17-20)23-12-14-29-27(18-23)28-19-24(13-15-30(28)34-29)35-31-10-6-4-8-25(31)26-9-5-7-11-32(26)35/h4-19,34H,1-3H3
InChIKeyWHZHVQQGOJJGDG-UHFFFAOYSA-N
XLogP9.01
TPSA20.72 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500450.59
LogP ≤ 59.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

9-phenyl-3-[9-(9-phenylcarbazol-3-yl)-6-(2,4,6-trimethylphenyl)carbazol-3-yl]-6-(2,4,6-trimethylphenyl)carbazole
CID 71232756
3-carbazol-9-yl-9-[9-[9-[9-[9-[9-(9H-carbazol-3-yl)carbazol-3-yl]carbazol-3-yl]carbazol-3-yl]carbazol-3-yl]carbazol-3-yl]carbazole
CID 25208834
3-(9-phenylcarbazol-3-yl)-6-[4-(9-phenylcarbazol-3-yl)phenyl]-9H-carbazole
CID 59307187
3,6-bis[9-(2-methylphenyl)carbazol-3-yl]-9H-carbazole
CID 59307119
3,6-bis(3-carbazol-9-yl-4,5-dimethylphenyl)-9H-carbazole
CID 118369111
3-carbazol-9-yl-9-(2,4,5-trimethylphenyl)-6-[3-[9-(2,4,6-trimethylphenyl)carbazol-3-yl]carbazol-9-yl]carbazole
CID 71232676
3-(9-dibenzothiophen-2-ylcarbazol-3-yl)-9-(2,4,6-trimethylphenyl)carbazole
CID 71232544
3-(9-dibenzothiophen-2-ylcarbazol-3-yl)-9-[9-(2,4,6-trimethylphenyl)carbazol-3-yl]carbazole
CID 71232829
(Z)-but-2-ene;3-(9H-carbazol-3-yl)-9-phenylcarbazole
CID 145055834
bis(3-carbazol-9-yl-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole);9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole
CID 159641883
3-(9-phenylcarbazol-3-yl)-9-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazole
CID 174179535
3-carbazol-9-yl-9-[4-(4,6-diphenylpyrimidin-2-yl)-2,6-diphenylphenyl]-6-(2,4,6-trimethylphenyl)carbazole
CID 146280880

Frequently Asked Questions

What is the IUPAC name of 3-carbazol-9-yl-6-(2,4,6-trimethylphenyl)-9H-carbazole?
The IUPAC name of 3-carbazol-9-yl-6-(2,4,6-trimethylphenyl)-9H-carbazole (CID 146281218) is 3-carbazol-9-yl-6-(2,4,6-trimethylphenyl)-9H-carbazole.
What is the SMILES notation for 3-carbazol-9-yl-6-(2,4,6-trimethylphenyl)-9H-carbazole?
The canonical SMILES for 3-carbazol-9-yl-6-(2,4,6-trimethylphenyl)-9H-carbazole is Cc1cc(C)c(-c2ccc3[nH]c4ccc(-n5c6ccccc6c6ccccc65)cc4c3c2)c(C)c1.
What is the InChIKey of 3-carbazol-9-yl-6-(2,4,6-trimethylphenyl)-9H-carbazole?
The InChIKey is WHZHVQQGOJJGDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H26N2/c1-20-16-21(2)33(22(3)17-20)23-12-14-29-27(18-23)28-19-24(13-15-30(28)34-29)35-31-10-6-4-8-25(31)26-9-5-7-11-32(26)35/h4-19,34H,1-3H3.
What are the key properties of 3-carbazol-9-yl-6-(2,4,6-trimethylphenyl)-9H-carbazole?
3-carbazol-9-yl-6-(2,4,6-trimethylphenyl)-9H-carbazole has a molecular weight of 450.59 g/mol, XLogP of 9.01, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-carbazol-9-yl-6-(2,4,6-trimethylphenyl)-9H-carbazole is sourced from PubChem (CID 146281218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).