3-phenyl-9-(7-phenyldibenzofuran-2-yl)carbazole

C36H23NO — CID 170286211

IUPAC3-phenyl-9-(7-phenyldibenzofuran-2-yl)carbazole
SMILESc1ccc(-c2ccc3c(c2)oc2ccc(-n4c5ccccc5c5cc(-c6ccccc6)ccc54)cc23)cc1
InChIInChI=1S/C36H23NO/c1-3-9-24(10-4-1)26-16-19-34-31(21-26)29-13-7-8-14-33(29)37(34)28-17-20-35-32(23-28)30-18-15-27(22-36(30)38-35)25-11-5-2-6-12-25/h1-23H
InChIKeyKQOZDKSMOOLIIO-UHFFFAOYSA-N
MW485.59 g/mol
LogP10.02
Rot. Bonds3

About 3-phenyl-9-(7-phenyldibenzofuran-2-yl)carbazole

3-phenyl-9-(7-phenyldibenzofuran-2-yl)carbazole (PubChem CID 170286211) has the molecular formula C36H23NO and a molecular weight of 485.59 g/mol. Its IUPAC name is 3-phenyl-9-(7-phenyldibenzofuran-2-yl)carbazole.

Molecular Properties

Compound Name3-phenyl-9-(7-phenyldibenzofuran-2-yl)carbazole
PubChem CID170286211
Molecular FormulaC36H23NO
Molecular Weight485.59 g/mol
Exact Mass485.18
IUPAC Name3-phenyl-9-(7-phenyldibenzofuran-2-yl)carbazole
SMILESc1ccc(-c2ccc3c(c2)oc2ccc(-n4c5ccccc5c5cc(-c6ccccc6)ccc54)cc23)cc1
InChIInChI=1S/C36H23NO/c1-3-9-24(10-4-1)26-16-19-34-31(21-26)29-13-7-8-14-33(29)37(34)28-17-20-35-32(23-28)30-18-15-27(22-36(30)38-35)25-11-5-2-6-12-25/h1-23H
InChIKeyKQOZDKSMOOLIIO-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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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-9-(7-phenyldibenzofuran-2-yl)carbazole?
The IUPAC name of 3-phenyl-9-(7-phenyldibenzofuran-2-yl)carbazole (CID 170286211) is 3-phenyl-9-(7-phenyldibenzofuran-2-yl)carbazole.
What is the SMILES notation for 3-phenyl-9-(7-phenyldibenzofuran-2-yl)carbazole?
The canonical SMILES for 3-phenyl-9-(7-phenyldibenzofuran-2-yl)carbazole is c1ccc(-c2ccc3c(c2)oc2ccc(-n4c5ccccc5c5cc(-c6ccccc6)ccc54)cc23)cc1.
What is the InChIKey of 3-phenyl-9-(7-phenyldibenzofuran-2-yl)carbazole?
The InChIKey is KQOZDKSMOOLIIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H23NO/c1-3-9-24(10-4-1)26-16-19-34-31(21-26)29-13-7-8-14-33(29)37(34)28-17-20-35-32(23-28)30-18-15-27(22-36(30)38-35)25-11-5-2-6-12-25/h1-23H.
What are the key properties of 3-phenyl-9-(7-phenyldibenzofuran-2-yl)carbazole?
3-phenyl-9-(7-phenyldibenzofuran-2-yl)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 3-phenyl-9-(7-phenyldibenzofuran-2-yl)carbazole is sourced from PubChem (CID 170286211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).