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

C108H70N2O2 — CID 159217991

IUPAC9-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
SMILESc1ccc(-c2ccc(-c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc(-c4cccc5c4oc4c(-c6ccccc6)cccc45)c3)cc2)cc1.c1ccc(-c2cccc(-c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc(-c4cccc5c4oc4c(-c6ccccc6)cccc45)c3)c2)cc1
InChIInChI=1S/2C54H35NO/c1-4-15-36(16-5-1)38-19-12-20-39(31-38)41-32-42(40-29-30-52-50(35-40)47-23-10-11-28-51(47)55(52)44-21-8-3-9-22-44)34-43(33-41)46-25-14-27-49-48-26-13-24-45(53(48)56-54(46)49)37-17-6-2-7-18-37;1-4-14-36(15-5-1)37-26-28-38(29-27-37)41-32-42(40-30-31-52-50(35-40)47-20-10-11-25-51(47)55(52)44-18-8-3-9-19-44)34-43(33-41)46-22-13-24-49-48-23-12-21-45(53(48)56-54(46)49)39-16-6-2-7-17-39/h2*1-35H
InChIKeyKRIARPPWPZKLGJ-UHFFFAOYSA-N
MW1427.76 g/mol
LogP30.04
Rot. Bonds12

About 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

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 (PubChem CID 159217991) has the molecular formula C108H70N2O2 and a molecular weight of 1427.76 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name9-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
PubChem CID159217991
Molecular FormulaC108H70N2O2
Molecular Weight1427.76 g/mol
Exact Mass1426.54
IUPAC Name9-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
SMILESc1ccc(-c2ccc(-c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc(-c4cccc5c4oc4c(-c6ccccc6)cccc45)c3)cc2)cc1.c1ccc(-c2cccc(-c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc(-c4cccc5c4oc4c(-c6ccccc6)cccc45)c3)c2)cc1
InChIInChI=1S/2C54H35NO/c1-4-15-36(16-5-1)38-19-12-20-39(31-38)41-32-42(40-29-30-52-50(35-40)47-23-10-11-28-51(47)55(52)44-21-8-3-9-22-44)34-43(33-41)46-25-14-27-49-48-26-13-24-45(53(48)56-54(46)49)37-17-6-2-7-18-37;1-4-14-36(15-5-1)37-26-28-38(29-27-37)41-32-42(40-30-31-52-50(35-40)47-20-10-11-25-51(47)55(52)44-18-8-3-9-19-44)34-43(33-41)46-22-13-24-49-48-23-12-21-45(53(48)56-54(46)49)39-16-6-2-7-17-39/h2*1-35H
InChIKeyKRIARPPWPZKLGJ-UHFFFAOYSA-N
XLogP30.04
TPSA36.14 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms112
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001427.76
LogP ≤ 530.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 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 with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is c1ccc(-c2ccc(-c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc(-c4cccc5c4oc4c(-c6ccccc6)cccc45)c3)cc2)cc1.c1ccc(-c2cccc(-c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc(-c4cccc5c4oc4c(-c6ccccc6)cccc45)c3)c2)cc1.
What is the InChIKey of 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?
The InChIKey is KRIARPPWPZKLGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C54H35NO/c1-4-15-36(16-5-1)38-19-12-20-39(31-38)41-32-42(40-29-30-52-50(35-40)47-23-10-11-28-51(47)55(52)44-21-8-3-9-22-44)34-43(33-41)46-25-14-27-49-48-26-13-24-45(53(48)56-54(46)49)37-17-6-2-7-18-37;1-4-14-36(15-5-1)37-26-28-38(29-27-37)41-32-42(40-30-31-52-50(35-40)47-20-10-11-25-51(47)55(52)44-18-8-3-9-19-44)34-43(33-41)46-22-13-24-49-48-23-12-21-45(53(48)56-54(46)49)39-16-6-2-7-17-39/h2*1-35H.
What are the key properties of 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?
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 has a molecular weight of 1427.76 g/mol, XLogP of 30.04, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 159217991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).