7-(11-phenylbenzo[a]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-1-amine;N-(3-phenylphenyl)-N-(4-phenylphenyl)-7-[9-(3-phenylphenyl)fluoren-9-yl]dibenzofuran-3-amine

C120H80N2O2 — CID 163721882

IUPAC7-(11-phenylbenzo[a]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-1-amine;N-(3-phenylphenyl)-N-(4-phenylphenyl)-7-[9-(3-phenylphenyl)fluoren-9-yl]dibenzofuran-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc4oc5cc(C6(c7ccccc7)c7ccccc7-c7ccc8ccccc8c76)ccc5c34)cc2)cc1.c1ccc(-c2ccc(N(c3cccc(-c4ccccc4)c3)c3ccc4c(c3)oc3cc(C5(c6cccc(-c7ccccc7)c6)c6ccccc6-c6ccccc65)ccc34)cc2)cc1
InChIInChI=1S/C61H41NO.C59H39NO/c1-4-16-42(17-5-1)45-30-33-50(34-31-45)62(51-25-15-23-47(39-51)44-20-8-3-9-21-44)52-35-37-56-55-36-32-49(40-59(55)63-60(56)41-52)61(48-24-14-22-46(38-48)43-18-6-2-7-19-43)57-28-12-10-26-53(57)54-27-11-13-29-58(54)61;1-4-15-40(16-5-1)42-27-33-47(34-28-42)60(48-35-29-43(30-36-48)41-17-6-2-7-18-41)54-25-14-26-55-57(54)52-38-32-46(39-56(52)61-55)59(45-20-8-3-9-21-45)53-24-13-12-23-50(53)51-37-31-44-19-10-11-22-49(44)58(51)59/h1-41H;1-39H
InChIKeyKSGNIKAKQQDLTI-UHFFFAOYSA-N
MW1581.97 g/mol
LogP32.33
Rot. Bonds15

About 7-(11-phenylbenzo[a]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-1-amine;N-(3-phenylphenyl)-N-(4-phenylphenyl)-7-[9-(3-phenylphenyl)fluoren-9-yl]dibenzofuran-3-amine

7-(11-phenylbenzo[a]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-1-amine;N-(3-phenylphenyl)-N-(4-phenylphenyl)-7-[9-(3-phenylphenyl)fluoren-9-yl]dibenzofuran-3-amine (PubChem CID 163721882) has the molecular formula C120H80N2O2 and a molecular weight of 1581.97 g/mol. Its IUPAC name is 7-(11-phenylbenzo[a]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-1-amine;N-(3-phenylphenyl)-N-(4-phenylphenyl)-7-[9-(3-phenylphenyl)fluoren-9-yl]dibenzofuran-3-amine.

Molecular Properties

Compound Name7-(11-phenylbenzo[a]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-1-amine;N-(3-phenylphenyl)-N-(4-phenylphenyl)-7-[9-(3-phenylphenyl)fluoren-9-yl]dibenzofuran-3-amine
PubChem CID163721882
Molecular FormulaC120H80N2O2
Molecular Weight1581.97 g/mol
Exact Mass1580.62
IUPAC Name7-(11-phenylbenzo[a]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-1-amine;N-(3-phenylphenyl)-N-(4-phenylphenyl)-7-[9-(3-phenylphenyl)fluoren-9-yl]dibenzofuran-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc4oc5cc(C6(c7ccccc7)c7ccccc7-c7ccc8ccccc8c76)ccc5c34)cc2)cc1.c1ccc(-c2ccc(N(c3cccc(-c4ccccc4)c3)c3ccc4c(c3)oc3cc(C5(c6cccc(-c7ccccc7)c6)c6ccccc6-c6ccccc65)ccc34)cc2)cc1
InChIInChI=1S/C61H41NO.C59H39NO/c1-4-16-42(17-5-1)45-30-33-50(34-31-45)62(51-25-15-23-47(39-51)44-20-8-3-9-21-44)52-35-37-56-55-36-32-49(40-59(55)63-60(56)41-52)61(48-24-14-22-46(38-48)43-18-6-2-7-19-43)57-28-12-10-26-53(57)54-27-11-13-29-58(54)61;1-4-15-40(16-5-1)42-27-33-47(34-28-42)60(48-35-29-43(30-36-48)41-17-6-2-7-18-41)54-25-14-26-55-57(54)52-38-32-46(39-56(52)61-55)59(45-20-8-3-9-21-45)53-24-13-12-23-50(53)51-37-31-44-19-10-11-22-49(44)58(51)59/h1-41H;1-39H
InChIKeyKSGNIKAKQQDLTI-UHFFFAOYSA-N
XLogP32.33
TPSA32.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds15
Heavy Atoms124
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001581.97
LogP ≤ 532.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 7-(11-phenylbenzo[a]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-1-amine;N-(3-phenylphenyl)-N-(4-phenylphenyl)-7-[9-(3-phenylphenyl)fluoren-9-yl]dibenzofuran-3-amine with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 7-(11-phenylbenzo[a]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-1-amine;N-(3-phenylphenyl)-N-(4-phenylphenyl)-7-[9-(3-phenylphenyl)fluoren-9-yl]dibenzofuran-3-amine?
The IUPAC name of 7-(11-phenylbenzo[a]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-1-amine;N-(3-phenylphenyl)-N-(4-phenylphenyl)-7-[9-(3-phenylphenyl)fluoren-9-yl]dibenzofuran-3-amine (CID 163721882) is 7-(11-phenylbenzo[a]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-1-amine;N-(3-phenylphenyl)-N-(4-phenylphenyl)-7-[9-(3-phenylphenyl)fluoren-9-yl]dibenzofuran-3-amine.
What is the SMILES notation for 7-(11-phenylbenzo[a]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-1-amine;N-(3-phenylphenyl)-N-(4-phenylphenyl)-7-[9-(3-phenylphenyl)fluoren-9-yl]dibenzofuran-3-amine?
The canonical SMILES for 7-(11-phenylbenzo[a]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-1-amine;N-(3-phenylphenyl)-N-(4-phenylphenyl)-7-[9-(3-phenylphenyl)fluoren-9-yl]dibenzofuran-3-amine is c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc4oc5cc(C6(c7ccccc7)c7ccccc7-c7ccc8ccccc8c76)ccc5c34)cc2)cc1.c1ccc(-c2ccc(N(c3cccc(-c4ccccc4)c3)c3ccc4c(c3)oc3cc(C5(c6cccc(-c7ccccc7)c6)c6ccccc6-c6ccccc65)ccc34)cc2)cc1.
What is the InChIKey of 7-(11-phenylbenzo[a]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-1-amine;N-(3-phenylphenyl)-N-(4-phenylphenyl)-7-[9-(3-phenylphenyl)fluoren-9-yl]dibenzofuran-3-amine?
The InChIKey is KSGNIKAKQQDLTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H41NO.C59H39NO/c1-4-16-42(17-5-1)45-30-33-50(34-31-45)62(51-25-15-23-47(39-51)44-20-8-3-9-21-44)52-35-37-56-55-36-32-49(40-59(55)63-60(56)41-52)61(48-24-14-22-46(38-48)43-18-6-2-7-19-43)57-28-12-10-26-53(57)54-27-11-13-29-58(54)61;1-4-15-40(16-5-1)42-27-33-47(34-28-42)60(48-35-29-43(30-36-48)41-17-6-2-7-18-41)54-25-14-26-55-57(54)52-38-32-46(39-56(52)61-55)59(45-20-8-3-9-21-45)53-24-13-12-23-50(53)51-37-31-44-19-10-11-22-49(44)58(51)59/h1-41H;1-39H.
What are the key properties of 7-(11-phenylbenzo[a]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-1-amine;N-(3-phenylphenyl)-N-(4-phenylphenyl)-7-[9-(3-phenylphenyl)fluoren-9-yl]dibenzofuran-3-amine?
7-(11-phenylbenzo[a]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-1-amine;N-(3-phenylphenyl)-N-(4-phenylphenyl)-7-[9-(3-phenylphenyl)fluoren-9-yl]dibenzofuran-3-amine has a molecular weight of 1581.97 g/mol, XLogP of 32.33, 15 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(11-phenylbenzo[a]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-1-amine;N-(3-phenylphenyl)-N-(4-phenylphenyl)-7-[9-(3-phenylphenyl)fluoren-9-yl]dibenzofuran-3-amine is sourced from PubChem (CID 163721882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).