3-dibenzofuran-1-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine;3-dibenzofuran-2-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine

C120H80N4O2 — CID 164993214

IUPAC3-dibenzofuran-1-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine;3-dibenzofuran-2-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4cc5c(cc4-c4ccc6oc7ccccc7c6c4)c4ccccc4n5-c4ccccc4)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4cc5c(cc4-c4cccc6oc7ccccc7c46)c4ccccc4n5-c4ccccc4)cc3)cc2)cc1
InChIInChI=1S/2C60H40N2O/c1-4-15-41(16-5-1)43-27-29-44(30-28-43)46-33-37-49(38-34-46)61(48-35-31-45(32-36-48)42-17-6-2-7-18-42)56-40-57-53(50-21-10-12-24-55(50)62(57)47-19-8-3-9-20-47)39-54(56)51-23-14-26-59-60(51)52-22-11-13-25-58(52)63-59;1-4-14-41(15-5-1)43-24-26-44(27-25-43)46-30-35-50(36-31-46)61(49-33-28-45(29-34-49)42-16-6-2-7-17-42)57-40-58-54(51-20-10-12-22-56(51)62(58)48-18-8-3-9-19-48)39-53(57)47-32-37-60-55(38-47)52-21-11-13-23-59(52)63-60/h2*1-40H
InChIKeyHDVXOXOGRVYPHB-UHFFFAOYSA-N
MW1609.99 g/mol
LogP33.64
Rot. Bonds16

About 3-dibenzofuran-1-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine;3-dibenzofuran-2-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine

3-dibenzofuran-1-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine;3-dibenzofuran-2-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine (PubChem CID 164993214) has the molecular formula C120H80N4O2 and a molecular weight of 1609.99 g/mol. Its IUPAC name is 3-dibenzofuran-1-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine;3-dibenzofuran-2-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine.

Molecular Properties

Compound Name3-dibenzofuran-1-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine;3-dibenzofuran-2-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine
PubChem CID164993214
Molecular FormulaC120H80N4O2
Molecular Weight1609.99 g/mol
Exact Mass1608.63
IUPAC Name3-dibenzofuran-1-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine;3-dibenzofuran-2-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4cc5c(cc4-c4ccc6oc7ccccc7c6c4)c4ccccc4n5-c4ccccc4)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4cc5c(cc4-c4cccc6oc7ccccc7c46)c4ccccc4n5-c4ccccc4)cc3)cc2)cc1
InChIInChI=1S/2C60H40N2O/c1-4-15-41(16-5-1)43-27-29-44(30-28-43)46-33-37-49(38-34-46)61(48-35-31-45(32-36-48)42-17-6-2-7-18-42)56-40-57-53(50-21-10-12-24-55(50)62(57)47-19-8-3-9-20-47)39-54(56)51-23-14-26-59-60(51)52-22-11-13-25-58(52)63-59;1-4-14-41(15-5-1)43-24-26-44(27-25-43)46-30-35-50(36-31-46)61(49-33-28-45(29-34-49)42-16-6-2-7-17-42)57-40-58-54(51-20-10-12-22-56(51)62(58)48-18-8-3-9-19-48)39-53(57)47-32-37-60-55(38-47)52-21-11-13-23-59(52)63-60/h2*1-40H
InChIKeyHDVXOXOGRVYPHB-UHFFFAOYSA-N
XLogP33.64
TPSA42.62 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds16
Heavy Atoms126
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001609.99
LogP ≤ 533.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 3-dibenzofuran-1-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine;3-dibenzofuran-2-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-dibenzofuran-1-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine;3-dibenzofuran-2-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine?
The IUPAC name of 3-dibenzofuran-1-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine;3-dibenzofuran-2-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine (CID 164993214) is 3-dibenzofuran-1-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine;3-dibenzofuran-2-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine.
What is the SMILES notation for 3-dibenzofuran-1-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine;3-dibenzofuran-2-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine?
The canonical SMILES for 3-dibenzofuran-1-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine;3-dibenzofuran-2-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine is c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4cc5c(cc4-c4ccc6oc7ccccc7c6c4)c4ccccc4n5-c4ccccc4)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4cc5c(cc4-c4cccc6oc7ccccc7c46)c4ccccc4n5-c4ccccc4)cc3)cc2)cc1.
What is the InChIKey of 3-dibenzofuran-1-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine;3-dibenzofuran-2-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine?
The InChIKey is HDVXOXOGRVYPHB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C60H40N2O/c1-4-15-41(16-5-1)43-27-29-44(30-28-43)46-33-37-49(38-34-46)61(48-35-31-45(32-36-48)42-17-6-2-7-18-42)56-40-57-53(50-21-10-12-24-55(50)62(57)47-19-8-3-9-20-47)39-54(56)51-23-14-26-59-60(51)52-22-11-13-25-58(52)63-59;1-4-14-41(15-5-1)43-24-26-44(27-25-43)46-30-35-50(36-31-46)61(49-33-28-45(29-34-49)42-16-6-2-7-17-42)57-40-58-54(51-20-10-12-22-56(51)62(58)48-18-8-3-9-19-48)39-53(57)47-32-37-60-55(38-47)52-21-11-13-23-59(52)63-60/h2*1-40H.
What are the key properties of 3-dibenzofuran-1-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine;3-dibenzofuran-2-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine?
3-dibenzofuran-1-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine;3-dibenzofuran-2-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine has a molecular weight of 1609.99 g/mol, XLogP of 33.64, 16 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-dibenzofuran-1-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine;3-dibenzofuran-2-yl-9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine is sourced from PubChem (CID 164993214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).