N-(4-dibenzofuran-1-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-2-amine;N-dibenzothiophen-2-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine;N-dibenzothiophen-4-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine

C153H97N3OS5 — CID 159716995

IUPACN-(4-dibenzofuran-1-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-2-amine;N-dibenzothiophen-2-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine;N-dibenzothiophen-4-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine
SMILESc1ccc(C2(c3ccccc3)c3ccccc3-c3c(N(c4ccc(-c5cccc6oc7ccccc7c56)cc4)c4ccc5sc6ccccc6c5c4)cccc32)cc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3c(N(c4ccc5sc6ccccc6c5c4)c4cccc5c4sc4ccccc45)cccc32)cc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3c(N(c4cccc5c4sc4ccccc45)c4cccc5c4sc4ccccc45)cccc32)cc1
InChIInChI=1S/C55H35NOS.2C49H31NS2/c1-3-15-37(16-4-1)55(38-17-5-2-6-18-38)46-23-10-7-20-43(46)54-47(55)24-14-25-48(54)56(40-33-34-52-45(35-40)42-19-9-12-28-51(42)58-52)39-31-29-36(30-32-39)41-22-13-27-50-53(41)44-21-8-11-26-49(44)57-50;1-3-15-32(16-4-1)49(33-17-5-2-6-18-33)40-23-10-7-21-38(40)47-41(49)24-14-25-42(47)50(34-29-30-46-39(31-34)36-20-9-11-27-44(36)51-46)43-26-13-22-37-35-19-8-12-28-45(35)52-48(37)43;1-3-16-32(17-4-1)49(33-18-5-2-6-19-33)39-25-10-7-22-38(39)46-40(49)26-15-27-41(46)50(42-28-13-23-36-34-20-8-11-30-44(34)51-47(36)42)43-29-14-24-37-35-21-9-12-31-45(35)52-48(37)43/h1-35H;2*1-31H
InChIKeyMZODGXLVOITWSY-UHFFFAOYSA-N
MW2153.81 g/mol
LogP43.96
Rot. Bonds16

About N-(4-dibenzofuran-1-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-2-amine;N-dibenzothiophen-2-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine;N-dibenzothiophen-4-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine

N-(4-dibenzofuran-1-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-2-amine;N-dibenzothiophen-2-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine;N-dibenzothiophen-4-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine (PubChem CID 159716995) has the molecular formula C153H97N3OS5 and a molecular weight of 2153.81 g/mol. Its IUPAC name is N-(4-dibenzofuran-1-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-2-amine;N-dibenzothiophen-2-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine;N-dibenzothiophen-4-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine.

Molecular Properties

Compound NameN-(4-dibenzofuran-1-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-2-amine;N-dibenzothiophen-2-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine;N-dibenzothiophen-4-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine
PubChem CID159716995
Molecular FormulaC153H97N3OS5
Molecular Weight2153.81 g/mol
Exact Mass2151.62
IUPAC NameN-(4-dibenzofuran-1-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-2-amine;N-dibenzothiophen-2-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine;N-dibenzothiophen-4-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine
SMILESc1ccc(C2(c3ccccc3)c3ccccc3-c3c(N(c4ccc(-c5cccc6oc7ccccc7c56)cc4)c4ccc5sc6ccccc6c5c4)cccc32)cc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3c(N(c4ccc5sc6ccccc6c5c4)c4cccc5c4sc4ccccc45)cccc32)cc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3c(N(c4cccc5c4sc4ccccc45)c4cccc5c4sc4ccccc45)cccc32)cc1
InChIInChI=1S/C55H35NOS.2C49H31NS2/c1-3-15-37(16-4-1)55(38-17-5-2-6-18-38)46-23-10-7-20-43(46)54-47(55)24-14-25-48(54)56(40-33-34-52-45(35-40)42-19-9-12-28-51(42)58-52)39-31-29-36(30-32-39)41-22-13-27-50-53(41)44-21-8-11-26-49(44)57-50;1-3-15-32(16-4-1)49(33-17-5-2-6-18-33)40-23-10-7-21-38(40)47-41(49)24-14-25-42(47)50(34-29-30-46-39(31-34)36-20-9-11-27-44(36)51-46)43-26-13-22-37-35-19-8-12-28-45(35)52-48(37)43;1-3-16-32(17-4-1)49(33-18-5-2-6-19-33)39-25-10-7-22-38(39)46-40(49)26-15-27-41(46)50(42-28-13-23-36-34-20-8-11-30-44(34)51-47(36)42)43-29-14-24-37-35-21-9-12-31-45(35)52-48(37)43/h1-35H;2*1-31H
InChIKeyMZODGXLVOITWSY-UHFFFAOYSA-N
XLogP43.96
TPSA22.86 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds16
Heavy Atoms162
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002153.81
LogP ≤ 543.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze N-(4-dibenzofuran-1-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-2-amine;N-dibenzothiophen-2-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine;N-dibenzothiophen-4-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine with MolForge

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Related Compounds

N-(4-dibenzofuran-1-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-2-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-2-amine;N-(4-dibenzofuran-3-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-2-amine
CID 160753987
N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine
CID 121424362
N-(4-dibenzofuran-4-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine
CID 121424347
N-[4-(3-dibenzofuran-2-ylphenyl)phenyl]-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine
CID 121424368
N-(4-dibenzofuran-3-ylphenyl)-N-[4-(4-dibenzothiophen-2-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine
CID 121424451
N-(3-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-9,9-diphenylfluoren-4-amine
CID 121424235
N-dibenzothiophen-2-yl-N-(9,9-diphenylfluoren-4-yl)dibenzofuran-4-amine
CID 121424296
N-[4-(9,20-dithiapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14,16,18-nonaen-4-yl)phenyl]-N,9,9-triphenylfluoren-4-amine
CID 164956471
N-(4-dibenzofuran-4-ylphenyl)-N-(4-dibenzothiophen-2-ylphenyl)-9,9-diphenylfluoren-4-amine
CID 121424214
N-(4-dibenzofuran-4-ylphenyl)-N-(3-dibenzothiophen-2-ylphenyl)-9,9-diphenylfluoren-4-amine
CID 121424208
N,N-bis(4-dibenzothiophen-1-ylphenyl)-9,9-diphenylfluoren-4-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(3-dibenzothiophen-4-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine;N-(4-dibenzothiophen-1-ylphenyl)-N-(4-dibenzothiophen-2-ylphenyl)-9,9-diphenylfluoren-4-amine
CID 159643698
4-dibenzofuran-4-yl-N-[4-(3,5-diphenylphenyl)phenyl]-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[4-(3,5-diphenylphenyl)phenyl]-N-[4-(9-phenylfluoren-9-yl)phenyl]dibenzothiophen-2-amine;N-[4-(3,5-diphenylphenyl)phenyl]-N-[4-(9-phenylfluoren-9-yl)phenyl]dibenzothiophen-4-amine
CID 161095184

Frequently Asked Questions

What is the IUPAC name of N-(4-dibenzofuran-1-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-2-amine;N-dibenzothiophen-2-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine;N-dibenzothiophen-4-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine?
The IUPAC name of N-(4-dibenzofuran-1-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-2-amine;N-dibenzothiophen-2-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine;N-dibenzothiophen-4-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine (CID 159716995) is N-(4-dibenzofuran-1-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-2-amine;N-dibenzothiophen-2-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine;N-dibenzothiophen-4-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine.
What is the SMILES notation for N-(4-dibenzofuran-1-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-2-amine;N-dibenzothiophen-2-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine;N-dibenzothiophen-4-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine?
The canonical SMILES for N-(4-dibenzofuran-1-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-2-amine;N-dibenzothiophen-2-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine;N-dibenzothiophen-4-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine is c1ccc(C2(c3ccccc3)c3ccccc3-c3c(N(c4ccc(-c5cccc6oc7ccccc7c56)cc4)c4ccc5sc6ccccc6c5c4)cccc32)cc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3c(N(c4ccc5sc6ccccc6c5c4)c4cccc5c4sc4ccccc45)cccc32)cc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3c(N(c4cccc5c4sc4ccccc45)c4cccc5c4sc4ccccc45)cccc32)cc1.
What is the InChIKey of N-(4-dibenzofuran-1-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-2-amine;N-dibenzothiophen-2-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine;N-dibenzothiophen-4-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine?
The InChIKey is MZODGXLVOITWSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H35NOS.2C49H31NS2/c1-3-15-37(16-4-1)55(38-17-5-2-6-18-38)46-23-10-7-20-43(46)54-47(55)24-14-25-48(54)56(40-33-34-52-45(35-40)42-19-9-12-28-51(42)58-52)39-31-29-36(30-32-39)41-22-13-27-50-53(41)44-21-8-11-26-49(44)57-50;1-3-15-32(16-4-1)49(33-17-5-2-6-18-33)40-23-10-7-21-38(40)47-41(49)24-14-25-42(47)50(34-29-30-46-39(31-34)36-20-9-11-27-44(36)51-46)43-26-13-22-37-35-19-8-12-28-45(35)52-48(37)43;1-3-16-32(17-4-1)49(33-18-5-2-6-19-33)39-25-10-7-22-38(39)46-40(49)26-15-27-41(46)50(42-28-13-23-36-34-20-8-11-30-44(34)51-47(36)42)43-29-14-24-37-35-21-9-12-31-45(35)52-48(37)43/h1-35H;2*1-31H.
What are the key properties of N-(4-dibenzofuran-1-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-2-amine;N-dibenzothiophen-2-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine;N-dibenzothiophen-4-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine?
N-(4-dibenzofuran-1-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-2-amine;N-dibenzothiophen-2-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine;N-dibenzothiophen-4-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine has a molecular weight of 2153.81 g/mol, XLogP of 43.96, 16 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-dibenzofuran-1-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-2-amine;N-dibenzothiophen-2-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine;N-dibenzothiophen-4-yl-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine is sourced from PubChem (CID 159716995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).