N-dibenzofuran-3-yl-7-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[7-(9-phenylfluoren-9-yl)dibenzothiophen-3-yl]-N-(4-phenylphenyl)dibenzofuran-3-amine

C110H70N2O3S — CID 163987640

IUPACN-dibenzofuran-3-yl-7-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[7-(9-phenylfluoren-9-yl)dibenzothiophen-3-yl]-N-(4-phenylphenyl)dibenzofuran-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3ccc4c(c3)sc3cc(C5(c6ccccc6)c6ccccc6-c6ccccc65)ccc34)cc2)cc1.c1ccc(-c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3ccc4oc5cc(C6(c7ccccc7)c7ccccc7-c7ccccc76)ccc5c4c3)cc2)cc1
InChIInChI=1S/C55H35NO2.C55H35NOS/c1-3-13-36(14-4-1)37-23-26-40(27-24-37)56(42-28-31-46-45-19-9-12-22-51(45)57-54(46)35-42)41-29-32-52-48(34-41)47-30-25-39(33-53(47)58-52)55(38-15-5-2-6-16-38)49-20-10-7-17-43(49)44-18-8-11-21-50(44)55;1-3-13-36(14-4-1)37-23-26-40(27-24-37)56(41-28-31-46-45-19-9-12-22-51(45)57-52(46)34-41)42-29-32-48-47-30-25-39(33-53(47)58-54(48)35-42)55(38-15-5-2-6-16-38)49-20-10-7-17-43(49)44-18-8-11-21-50(44)55/h2*1-35H
InChIKeyTXTJRCZTQYEOFP-UHFFFAOYSA-N
MW1499.85 g/mol
LogP30.44
Rot. Bonds12

About N-dibenzofuran-3-yl-7-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[7-(9-phenylfluoren-9-yl)dibenzothiophen-3-yl]-N-(4-phenylphenyl)dibenzofuran-3-amine

N-dibenzofuran-3-yl-7-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[7-(9-phenylfluoren-9-yl)dibenzothiophen-3-yl]-N-(4-phenylphenyl)dibenzofuran-3-amine (PubChem CID 163987640) has the molecular formula C110H70N2O3S and a molecular weight of 1499.85 g/mol. Its IUPAC name is N-dibenzofuran-3-yl-7-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[7-(9-phenylfluoren-9-yl)dibenzothiophen-3-yl]-N-(4-phenylphenyl)dibenzofuran-3-amine.

Molecular Properties

Compound NameN-dibenzofuran-3-yl-7-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[7-(9-phenylfluoren-9-yl)dibenzothiophen-3-yl]-N-(4-phenylphenyl)dibenzofuran-3-amine
PubChem CID163987640
Molecular FormulaC110H70N2O3S
Molecular Weight1499.85 g/mol
Exact Mass1498.51
IUPAC NameN-dibenzofuran-3-yl-7-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[7-(9-phenylfluoren-9-yl)dibenzothiophen-3-yl]-N-(4-phenylphenyl)dibenzofuran-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3ccc4c(c3)sc3cc(C5(c6ccccc6)c6ccccc6-c6ccccc65)ccc34)cc2)cc1.c1ccc(-c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3ccc4oc5cc(C6(c7ccccc7)c7ccccc7-c7ccccc76)ccc5c4c3)cc2)cc1
InChIInChI=1S/C55H35NO2.C55H35NOS/c1-3-13-36(14-4-1)37-23-26-40(27-24-37)56(42-28-31-46-45-19-9-12-22-51(45)57-54(46)35-42)41-29-32-52-48(34-41)47-30-25-39(33-53(47)58-52)55(38-15-5-2-6-16-38)49-20-10-7-17-43(49)44-18-8-11-21-50(44)55;1-3-13-36(14-4-1)37-23-26-40(27-24-37)56(41-28-31-46-45-19-9-12-22-51(45)57-52(46)34-41)42-29-32-48-47-30-25-39(33-53(47)58-54(48)35-42)55(38-15-5-2-6-16-38)49-20-10-7-17-43(49)44-18-8-11-21-50(44)55/h2*1-35H
InChIKeyTXTJRCZTQYEOFP-UHFFFAOYSA-N
XLogP30.44
TPSA45.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms116
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001499.85
LogP ≤ 530.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-dibenzofuran-3-yl-7-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[7-(9-phenylfluoren-9-yl)dibenzothiophen-3-yl]-N-(4-phenylphenyl)dibenzofuran-3-amine with MolForge

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Related Compounds

9-dibenzofuran-3-yl-N,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;N-(9-dibenzofuran-2-yl-9-phenylfluoren-2-yl)-N-(4-phenylphenyl)dibenzothiophen-3-amine;9-dibenzofuran-3-yl-N,N,9-triphenylfluoren-2-amine
CID 157052053
N,N-diphenyl-4-[3-[7-(9-phenylfluoren-9-yl)dibenzofuran-2-yl]phenyl]aniline;3-phenyl-N-[3-[7-(9-phenylfluoren-9-yl)dibenzothiophen-3-yl]phenyl]-N-(4-phenylphenyl)aniline
CID 163830866
N-[4-(4-phenylphenyl)phenyl]-N-[9-phenyl-9-(4-phenylphenyl)fluoren-2-yl]dibenzofuran-3-amine;7-phenyl-N-[4-(4-phenylphenyl)phenyl]-N-[9-phenyl-9-(3-phenylphenyl)fluoren-2-yl]dibenzothiophen-3-amine;9-phenyl-9-(3-phenylphenyl)-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 163854265
8-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)dibenzofuran-3-amine;N-phenyl-8-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)dibenzofuran-3-amine;N-phenyl-8-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzothiophen-2-amine
CID 163747382
N-(4-naphthalen-1-ylphenyl)-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-3-amine;N-phenyl-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzothiophen-3-amine
CID 161396501
N-(9,9-dimethylfluoren-2-yl)-7-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine
CID 163926045
N-dibenzofuran-3-yl-7-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine
CID 163940771
3-N-dibenzofuran-2-yl-3-N-[3-(9-phenylfluoren-9-yl)phenyl]-1-N-(3-phenylphenyl)-1-N-(4-phenylphenyl)benzene-1,3-diamine
CID 155096723
N-(3-dibenzofuran-2-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]-3-(4-phenylphenyl)aniline
CID 121381640
N,N-diphenyl-8-(9-phenylfluoren-9-yl)dibenzofuran-3-amine;N,N-diphenyl-8-(9-phenylfluoren-9-yl)dibenzothiophen-2-amine;N-phenyl-7-(9-phenylfluoren-9-yl)-N-(2-phenylphenyl)dibenzofuran-1-amine
CID 163683268
N,N-diphenyl-4-[3-[7-(9-phenylfluoren-9-yl)dibenzofuran-1-yl]phenyl]aniline;N,N-diphenyl-4-[3-[7-(9-phenylfluoren-9-yl)dibenzothiophen-1-yl]phenyl]aniline;3-phenyl-N-[3-[7-(9-phenylfluoren-9-yl)dibenzofuran-1-yl]phenyl]-N-(4-phenylphenyl)aniline
CID 163508412
N-phenyl-N-[7-(9-phenylfluoren-9-yl)dibenzothiophen-1-yl]dibenzofuran-3-amine
CID 163626827

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-3-yl-7-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[7-(9-phenylfluoren-9-yl)dibenzothiophen-3-yl]-N-(4-phenylphenyl)dibenzofuran-3-amine?
The IUPAC name of N-dibenzofuran-3-yl-7-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[7-(9-phenylfluoren-9-yl)dibenzothiophen-3-yl]-N-(4-phenylphenyl)dibenzofuran-3-amine (CID 163987640) is N-dibenzofuran-3-yl-7-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[7-(9-phenylfluoren-9-yl)dibenzothiophen-3-yl]-N-(4-phenylphenyl)dibenzofuran-3-amine.
What is the SMILES notation for N-dibenzofuran-3-yl-7-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[7-(9-phenylfluoren-9-yl)dibenzothiophen-3-yl]-N-(4-phenylphenyl)dibenzofuran-3-amine?
The canonical SMILES for N-dibenzofuran-3-yl-7-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[7-(9-phenylfluoren-9-yl)dibenzothiophen-3-yl]-N-(4-phenylphenyl)dibenzofuran-3-amine is c1ccc(-c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3ccc4c(c3)sc3cc(C5(c6ccccc6)c6ccccc6-c6ccccc65)ccc34)cc2)cc1.c1ccc(-c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3ccc4oc5cc(C6(c7ccccc7)c7ccccc7-c7ccccc76)ccc5c4c3)cc2)cc1.
What is the InChIKey of N-dibenzofuran-3-yl-7-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[7-(9-phenylfluoren-9-yl)dibenzothiophen-3-yl]-N-(4-phenylphenyl)dibenzofuran-3-amine?
The InChIKey is TXTJRCZTQYEOFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H35NO2.C55H35NOS/c1-3-13-36(14-4-1)37-23-26-40(27-24-37)56(42-28-31-46-45-19-9-12-22-51(45)57-54(46)35-42)41-29-32-52-48(34-41)47-30-25-39(33-53(47)58-52)55(38-15-5-2-6-16-38)49-20-10-7-17-43(49)44-18-8-11-21-50(44)55;1-3-13-36(14-4-1)37-23-26-40(27-24-37)56(41-28-31-46-45-19-9-12-22-51(45)57-52(46)34-41)42-29-32-48-47-30-25-39(33-53(47)58-54(48)35-42)55(38-15-5-2-6-16-38)49-20-10-7-17-43(49)44-18-8-11-21-50(44)55/h2*1-35H.
What are the key properties of N-dibenzofuran-3-yl-7-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[7-(9-phenylfluoren-9-yl)dibenzothiophen-3-yl]-N-(4-phenylphenyl)dibenzofuran-3-amine?
N-dibenzofuran-3-yl-7-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[7-(9-phenylfluoren-9-yl)dibenzothiophen-3-yl]-N-(4-phenylphenyl)dibenzofuran-3-amine has a molecular weight of 1499.85 g/mol, XLogP of 30.44, 12 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-3-yl-7-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[7-(9-phenylfluoren-9-yl)dibenzothiophen-3-yl]-N-(4-phenylphenyl)dibenzofuran-3-amine is sourced from PubChem (CID 163987640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).