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

C192H122N8O7 — CID 158442979

IUPACbis(N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine);N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-3-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine
SMILESc1ccc(-c2ccccc2N(c2ccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2)c2cccc3oc4ccccc4c23)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc6c(c5)oc5ccccc56)c5cccc6oc7ccccc7c56)cc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc6oc7ccccc7c6c5)c5cccc6oc7ccccc7c56)cc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc6oc7ccccc7c6c5)c5cccc6oc7ccccc7c56)cc4)ccc32)cc1
InChIInChI=1S/3C48H30N2O2.C48H32N2O/c1-2-11-33(12-3-1)50-41-16-7-4-13-36(41)40-29-32(23-28-42(40)50)31-21-24-34(25-22-31)49(35-26-27-38-37-14-5-8-18-44(37)52-47(38)30-35)43-17-10-20-46-48(43)39-15-6-9-19-45(39)51-46;2*1-2-11-33(12-3-1)50-41-16-7-4-13-36(41)39-29-32(23-27-42(39)50)31-21-24-34(25-22-31)49(35-26-28-46-40(30-35)37-14-5-8-18-44(37)51-46)43-17-10-20-47-48(43)38-15-6-9-19-45(38)52-47;1-3-14-34(15-4-1)38-18-7-10-21-42(38)50(45-23-13-25-47-48(45)40-20-9-12-24-46(40)51-47)37-29-26-33(27-30-37)35-28-31-44-41(32-35)39-19-8-11-22-43(39)49(44)36-16-5-2-6-17-36/h3*1-30H;1-32H
InChIKeyHDASCYZMWKWMHL-UHFFFAOYSA-N
MW2653.14 g/mol
LogP54.64
Rot. Bonds21

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

bis(N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine);N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-3-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine (PubChem CID 158442979) has the molecular formula C192H122N8O7 and a molecular weight of 2653.14 g/mol. Its IUPAC name is bis(N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine);N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-3-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine.

Molecular Properties

Compound Namebis(N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine);N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-3-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine
PubChem CID158442979
Molecular FormulaC192H122N8O7
Molecular Weight2653.14 g/mol
Exact Mass2650.94
IUPAC Namebis(N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine);N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-3-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine
SMILESc1ccc(-c2ccccc2N(c2ccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2)c2cccc3oc4ccccc4c23)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc6c(c5)oc5ccccc56)c5cccc6oc7ccccc7c56)cc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc6oc7ccccc7c6c5)c5cccc6oc7ccccc7c56)cc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc6oc7ccccc7c6c5)c5cccc6oc7ccccc7c56)cc4)ccc32)cc1
InChIInChI=1S/3C48H30N2O2.C48H32N2O/c1-2-11-33(12-3-1)50-41-16-7-4-13-36(41)40-29-32(23-28-42(40)50)31-21-24-34(25-22-31)49(35-26-27-38-37-14-5-8-18-44(37)52-47(38)30-35)43-17-10-20-46-48(43)39-15-6-9-19-45(39)51-46;2*1-2-11-33(12-3-1)50-41-16-7-4-13-36(41)39-29-32(23-27-42(39)50)31-21-24-34(25-22-31)49(35-26-28-46-40(30-35)37-14-5-8-18-44(37)51-46)43-17-10-20-47-48(43)38-15-6-9-19-45(38)52-47;1-3-14-34(15-4-1)38-18-7-10-21-42(38)50(45-23-13-25-47-48(45)40-20-9-12-24-46(40)51-47)37-29-26-33(27-30-37)35-28-31-44-41(32-35)39-19-8-11-22-43(39)49(44)36-16-5-2-6-17-36/h3*1-30H;1-32H
InChIKeyHDASCYZMWKWMHL-UHFFFAOYSA-N
XLogP54.64
TPSA124.66 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds21
Heavy Atoms207
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002653.14
LogP ≤ 554.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

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

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Frequently Asked Questions

What is the IUPAC name of bis(N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine);N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-3-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine?
The IUPAC name of bis(N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine);N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-3-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine (CID 158442979) is bis(N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine);N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-3-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine.
What is the SMILES notation for bis(N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine);N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-3-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine?
The canonical SMILES for bis(N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine);N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-3-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine is c1ccc(-c2ccccc2N(c2ccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2)c2cccc3oc4ccccc4c23)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc6c(c5)oc5ccccc56)c5cccc6oc7ccccc7c56)cc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc6oc7ccccc7c6c5)c5cccc6oc7ccccc7c56)cc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc6oc7ccccc7c6c5)c5cccc6oc7ccccc7c56)cc4)ccc32)cc1.
What is the InChIKey of bis(N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine);N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-3-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine?
The InChIKey is HDASCYZMWKWMHL-UHFFFAOYSA-N. The full InChI is InChI=1S/3C48H30N2O2.C48H32N2O/c1-2-11-33(12-3-1)50-41-16-7-4-13-36(41)40-29-32(23-28-42(40)50)31-21-24-34(25-22-31)49(35-26-27-38-37-14-5-8-18-44(37)52-47(38)30-35)43-17-10-20-46-48(43)39-15-6-9-19-45(39)51-46;2*1-2-11-33(12-3-1)50-41-16-7-4-13-36(41)39-29-32(23-27-42(39)50)31-21-24-34(25-22-31)49(35-26-28-46-40(30-35)37-14-5-8-18-44(37)51-46)43-17-10-20-47-48(43)38-15-6-9-19-45(38)52-47;1-3-14-34(15-4-1)38-18-7-10-21-42(38)50(45-23-13-25-47-48(45)40-20-9-12-24-46(40)51-47)37-29-26-33(27-30-37)35-28-31-44-41(32-35)39-19-8-11-22-43(39)49(44)36-16-5-2-6-17-36/h3*1-30H;1-32H.
What are the key properties of bis(N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine);N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-3-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine?
bis(N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine);N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-3-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine has a molecular weight of 2653.14 g/mol, XLogP of 54.64, 21 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for bis(N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine);N-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-3-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine is sourced from PubChem (CID 158442979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).