12-[9-(2-fluorodibenzofuran-4-yl)-6-phenylcarbazol-3-yl]-11-phenylindolo[2,3-a]carbazole

C54H32FN3O — CID 129294405

IUPAC12-[9-(2-fluorodibenzofuran-4-yl)-6-phenylcarbazol-3-yl]-11-phenylindolo[2,3-a]carbazole
SMILESFc1cc(-n2c3ccc(-c4ccccc4)cc3c3cc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)ccc32)c2oc3ccccc3c2c1
InChIInChI=1S/C54H32FN3O/c55-35-30-45-40-19-9-12-22-51(40)59-54(45)50(31-35)58-48-27-23-34(33-13-3-1-4-14-33)29-43(48)44-32-37(24-28-49(44)58)57-47-21-11-8-18-39(47)42-26-25-41-38-17-7-10-20-46(38)56(52(41)53(42)57)36-15-5-2-6-16-36/h1-32H
InChIKeySQZUKGYRTFSMNX-UHFFFAOYSA-N
MW757.87 g/mol
LogP14.68
Rot. Bonds4

About 12-[9-(2-fluorodibenzofuran-4-yl)-6-phenylcarbazol-3-yl]-11-phenylindolo[2,3-a]carbazole

12-[9-(2-fluorodibenzofuran-4-yl)-6-phenylcarbazol-3-yl]-11-phenylindolo[2,3-a]carbazole (PubChem CID 129294405) has the molecular formula C54H32FN3O and a molecular weight of 757.87 g/mol. Its IUPAC name is 12-[9-(2-fluorodibenzofuran-4-yl)-6-phenylcarbazol-3-yl]-11-phenylindolo[2,3-a]carbazole.

Molecular Properties

Compound Name12-[9-(2-fluorodibenzofuran-4-yl)-6-phenylcarbazol-3-yl]-11-phenylindolo[2,3-a]carbazole
PubChem CID129294405
Molecular FormulaC54H32FN3O
Molecular Weight757.87 g/mol
Exact Mass757.25
IUPAC Name12-[9-(2-fluorodibenzofuran-4-yl)-6-phenylcarbazol-3-yl]-11-phenylindolo[2,3-a]carbazole
SMILESFc1cc(-n2c3ccc(-c4ccccc4)cc3c3cc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)ccc32)c2oc3ccccc3c2c1
InChIInChI=1S/C54H32FN3O/c55-35-30-45-40-19-9-12-22-51(40)59-54(45)50(31-35)58-48-27-23-34(33-13-3-1-4-14-33)29-43(48)44-32-37(24-28-49(44)58)57-47-21-11-8-18-39(47)42-26-25-41-38-17-7-10-20-46(38)56(52(41)53(42)57)36-15-5-2-6-16-36/h1-32H
InChIKeySQZUKGYRTFSMNX-UHFFFAOYSA-N
XLogP14.68
TPSA27.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms59
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500757.87
LogP ≤ 514.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 12-[9-(2-fluorodibenzofuran-4-yl)-6-phenylcarbazol-3-yl]-11-phenylindolo[2,3-a]carbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 12-[9-(2-fluorodibenzofuran-4-yl)-6-phenylcarbazol-3-yl]-11-phenylindolo[2,3-a]carbazole?
The IUPAC name of 12-[9-(2-fluorodibenzofuran-4-yl)-6-phenylcarbazol-3-yl]-11-phenylindolo[2,3-a]carbazole (CID 129294405) is 12-[9-(2-fluorodibenzofuran-4-yl)-6-phenylcarbazol-3-yl]-11-phenylindolo[2,3-a]carbazole.
What is the SMILES notation for 12-[9-(2-fluorodibenzofuran-4-yl)-6-phenylcarbazol-3-yl]-11-phenylindolo[2,3-a]carbazole?
The canonical SMILES for 12-[9-(2-fluorodibenzofuran-4-yl)-6-phenylcarbazol-3-yl]-11-phenylindolo[2,3-a]carbazole is Fc1cc(-n2c3ccc(-c4ccccc4)cc3c3cc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)ccc32)c2oc3ccccc3c2c1.
What is the InChIKey of 12-[9-(2-fluorodibenzofuran-4-yl)-6-phenylcarbazol-3-yl]-11-phenylindolo[2,3-a]carbazole?
The InChIKey is SQZUKGYRTFSMNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H32FN3O/c55-35-30-45-40-19-9-12-22-51(40)59-54(45)50(31-35)58-48-27-23-34(33-13-3-1-4-14-33)29-43(48)44-32-37(24-28-49(44)58)57-47-21-11-8-18-39(47)42-26-25-41-38-17-7-10-20-46(38)56(52(41)53(42)57)36-15-5-2-6-16-36/h1-32H.
What are the key properties of 12-[9-(2-fluorodibenzofuran-4-yl)-6-phenylcarbazol-3-yl]-11-phenylindolo[2,3-a]carbazole?
12-[9-(2-fluorodibenzofuran-4-yl)-6-phenylcarbazol-3-yl]-11-phenylindolo[2,3-a]carbazole has a molecular weight of 757.87 g/mol, XLogP of 14.68, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 12-[9-(2-fluorodibenzofuran-4-yl)-6-phenylcarbazol-3-yl]-11-phenylindolo[2,3-a]carbazole is sourced from PubChem (CID 129294405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).