9-(4-methylphenyl)-2-(6-phenyldibenzofuran-4-yl)carbazole

C37H25NO — CID 118509061

IUPAC9-(4-methylphenyl)-2-(6-phenyldibenzofuran-4-yl)carbazole
SMILESCc1ccc(-n2c3ccccc3c3ccc(-c4cccc5c4oc4c(-c6ccccc6)cccc45)cc32)cc1
InChIInChI=1S/C37H25NO/c1-24-17-20-27(21-18-24)38-34-16-6-5-11-30(34)31-22-19-26(23-35(31)38)29-13-8-15-33-32-14-7-12-28(36(32)39-37(29)33)25-9-3-2-4-10-25/h2-23H,1H3
InChIKeyNMUUBMBMHILTPK-UHFFFAOYSA-N
MW499.61 g/mol
LogP10.33
Rot. Bonds3

About 9-(4-methylphenyl)-2-(6-phenyldibenzofuran-4-yl)carbazole

9-(4-methylphenyl)-2-(6-phenyldibenzofuran-4-yl)carbazole (PubChem CID 118509061) has the molecular formula C37H25NO and a molecular weight of 499.61 g/mol. Its IUPAC name is 9-(4-methylphenyl)-2-(6-phenyldibenzofuran-4-yl)carbazole.

Molecular Properties

Compound Name9-(4-methylphenyl)-2-(6-phenyldibenzofuran-4-yl)carbazole
PubChem CID118509061
Molecular FormulaC37H25NO
Molecular Weight499.61 g/mol
Exact Mass499.19
IUPAC Name9-(4-methylphenyl)-2-(6-phenyldibenzofuran-4-yl)carbazole
SMILESCc1ccc(-n2c3ccccc3c3ccc(-c4cccc5c4oc4c(-c6ccccc6)cccc45)cc32)cc1
InChIInChI=1S/C37H25NO/c1-24-17-20-27(21-18-24)38-34-16-6-5-11-30(34)31-22-19-26(23-35(31)38)29-13-8-15-33-32-14-7-12-28(36(32)39-37(29)33)25-9-3-2-4-10-25/h2-23H,1H3
InChIKeyNMUUBMBMHILTPK-UHFFFAOYSA-N
XLogP10.33
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms39
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500499.61
LogP ≤ 510.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-(4-methylphenyl)phenyl]-9-[4-(3-phenylphenyl)phenyl]carbazole
CID 118337077
11-(4-dibenzofuran-4-ylphenyl)-3,5-diphenylindolo[3,2-b]carbazole
CID 126580169
2,7-di(dibenzofuran-4-yl)-9-(4-phenylphenyl)carbazole
CID 139496633
3-(6-naphthalen-1-yldibenzofuran-4-yl)-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]-3-(6-phenyldibenzofuran-4-yl)carbazole
CID 158962666
9-(4-dibenzofuran-4-ylphenyl)-3-methylcarbazole
CID 129128081
9-phenyl-3-[3-(6-phenyldibenzofuran-4-yl)-5-(3-phenylphenyl)phenyl]carbazole;9-phenyl-3-[3-(6-phenyldibenzofuran-4-yl)-5-(4-phenylphenyl)phenyl]carbazole
CID 159217991
2-[9-[3-(3-dibenzofuran-4-ylphenyl)phenyl]carbazol-2-yl]-9-phenylcarbazole
CID 166509994
2-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-5,7-diphenylindolo[2,3-b]carbazole
CID 118020105
2-[9-(4-methylphenyl)carbazol-2-yl]phenol
CID 118682159
2-dibenzofuran-4-yl-5,7-diphenylindolo[2,3-b]carbazole;5-(4-dibenzofuran-4-ylphenyl)-7-phenylindolo[2,3-b]carbazole;5,7-diphenyl-2-(9-phenylcarbazol-3-yl)indolo[2,3-b]carbazole
CID 160885475
3-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole
CID 122501655
5-(3-dibenzofuran-4-ylphenyl)-7-(4-phenylphenyl)indolo[2,3-b]carbazole
CID 171414718

Frequently Asked Questions

What is the IUPAC name of 9-(4-methylphenyl)-2-(6-phenyldibenzofuran-4-yl)carbazole?
The IUPAC name of 9-(4-methylphenyl)-2-(6-phenyldibenzofuran-4-yl)carbazole (CID 118509061) is 9-(4-methylphenyl)-2-(6-phenyldibenzofuran-4-yl)carbazole.
What is the SMILES notation for 9-(4-methylphenyl)-2-(6-phenyldibenzofuran-4-yl)carbazole?
The canonical SMILES for 9-(4-methylphenyl)-2-(6-phenyldibenzofuran-4-yl)carbazole is Cc1ccc(-n2c3ccccc3c3ccc(-c4cccc5c4oc4c(-c6ccccc6)cccc45)cc32)cc1.
What is the InChIKey of 9-(4-methylphenyl)-2-(6-phenyldibenzofuran-4-yl)carbazole?
The InChIKey is NMUUBMBMHILTPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H25NO/c1-24-17-20-27(21-18-24)38-34-16-6-5-11-30(34)31-22-19-26(23-35(31)38)29-13-8-15-33-32-14-7-12-28(36(32)39-37(29)33)25-9-3-2-4-10-25/h2-23H,1H3.
What are the key properties of 9-(4-methylphenyl)-2-(6-phenyldibenzofuran-4-yl)carbazole?
9-(4-methylphenyl)-2-(6-phenyldibenzofuran-4-yl)carbazole has a molecular weight of 499.61 g/mol, XLogP of 10.33, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-methylphenyl)-2-(6-phenyldibenzofuran-4-yl)carbazole is sourced from PubChem (CID 118509061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).