9-[4-(8-phenyldibenzofuran-2-yl)phenyl]carbazole

C36H23NO — CID 58536267

IUPAC9-[4-(8-phenyldibenzofuran-2-yl)phenyl]carbazole
SMILESc1ccc(-c2ccc3oc4ccc(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)cc4c3c2)cc1
InChIInChI=1S/C36H23NO/c1-2-8-24(9-3-1)26-16-20-35-31(22-26)32-23-27(17-21-36(32)38-35)25-14-18-28(19-15-25)37-33-12-6-4-10-29(33)30-11-5-7-13-34(30)37/h1-23H
InChIKeyQQKJJRCMBNBJHX-UHFFFAOYSA-N
MW485.59 g/mol
LogP10.02
Rot. Bonds3

About 9-[4-(8-phenyldibenzofuran-2-yl)phenyl]carbazole

9-[4-(8-phenyldibenzofuran-2-yl)phenyl]carbazole (PubChem CID 58536267) has the molecular formula C36H23NO and a molecular weight of 485.59 g/mol. Its IUPAC name is 9-[4-(8-phenyldibenzofuran-2-yl)phenyl]carbazole.

Molecular Properties

Compound Name9-[4-(8-phenyldibenzofuran-2-yl)phenyl]carbazole
PubChem CID58536267
Molecular FormulaC36H23NO
Molecular Weight485.59 g/mol
Exact Mass485.18
IUPAC Name9-[4-(8-phenyldibenzofuran-2-yl)phenyl]carbazole
SMILESc1ccc(-c2ccc3oc4ccc(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)cc4c3c2)cc1
InChIInChI=1S/C36H23NO/c1-2-8-24(9-3-1)26-16-20-35-31(22-26)32-23-27(17-21-36(32)38-35)25-14-18-28(19-15-25)37-33-12-6-4-10-29(33)30-11-5-7-13-34(30)37/h1-23H
InChIKeyQQKJJRCMBNBJHX-UHFFFAOYSA-N
XLogP10.02
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms38
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500485.59
LogP ≤ 510.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-[4-(8-phenyldibenzofuran-2-yl)phenyl]carbazole?
The IUPAC name of 9-[4-(8-phenyldibenzofuran-2-yl)phenyl]carbazole (CID 58536267) is 9-[4-(8-phenyldibenzofuran-2-yl)phenyl]carbazole.
What is the SMILES notation for 9-[4-(8-phenyldibenzofuran-2-yl)phenyl]carbazole?
The canonical SMILES for 9-[4-(8-phenyldibenzofuran-2-yl)phenyl]carbazole is c1ccc(-c2ccc3oc4ccc(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)cc4c3c2)cc1.
What is the InChIKey of 9-[4-(8-phenyldibenzofuran-2-yl)phenyl]carbazole?
The InChIKey is QQKJJRCMBNBJHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H23NO/c1-2-8-24(9-3-1)26-16-20-35-31(22-26)32-23-27(17-21-36(32)38-35)25-14-18-28(19-15-25)37-33-12-6-4-10-29(33)30-11-5-7-13-34(30)37/h1-23H.
What are the key properties of 9-[4-(8-phenyldibenzofuran-2-yl)phenyl]carbazole?
9-[4-(8-phenyldibenzofuran-2-yl)phenyl]carbazole has a molecular weight of 485.59 g/mol, XLogP of 10.02, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-(8-phenyldibenzofuran-2-yl)phenyl]carbazole is sourced from PubChem (CID 58536267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).