8-(11-phenylbenzo[b]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-3-amine;8-(7-phenylbenzo[c]fluoren-7-yl)-N,N-bis(4-phenylphenyl)dibenzothiophen-4-amine

C118H78N2OS — CID 163609854

IUPAC8-(11-phenylbenzo[b]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-3-amine;8-(7-phenylbenzo[c]fluoren-7-yl)-N,N-bis(4-phenylphenyl)dibenzothiophen-4-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)oc3ccc(C5(c6ccccc6)c6ccccc6-c6cc7ccccc7cc65)cc34)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc4c3sc3ccc(C5(c6ccccc6)c6ccccc6-c6c5ccc5ccccc65)cc34)cc2)cc1
InChIInChI=1S/C59H39NO.C59H39NS/c1-4-14-40(15-5-1)42-24-29-48(30-25-42)60(49-31-26-43(27-32-49)41-16-6-2-7-17-41)50-33-34-52-54-38-47(28-35-57(54)61-58(52)39-50)59(46-20-8-3-9-21-46)55-23-13-12-22-51(55)53-36-44-18-10-11-19-45(44)37-56(53)59;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)55-26-14-24-50-52-39-46(32-38-56(52)61-58(50)55)59(45-20-8-3-9-21-45)53-25-13-12-23-51(53)57-49-22-11-10-19-44(49)31-37-54(57)59/h2*1-39H
InChIKeyHEYXSEAFXMNCQW-UHFFFAOYSA-N
MW1572.00 g/mol
LogP32.28
Rot. Bonds14

About 8-(11-phenylbenzo[b]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-3-amine;8-(7-phenylbenzo[c]fluoren-7-yl)-N,N-bis(4-phenylphenyl)dibenzothiophen-4-amine

8-(11-phenylbenzo[b]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-3-amine;8-(7-phenylbenzo[c]fluoren-7-yl)-N,N-bis(4-phenylphenyl)dibenzothiophen-4-amine (PubChem CID 163609854) has the molecular formula C118H78N2OS and a molecular weight of 1572.00 g/mol. Its IUPAC name is 8-(11-phenylbenzo[b]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-3-amine;8-(7-phenylbenzo[c]fluoren-7-yl)-N,N-bis(4-phenylphenyl)dibenzothiophen-4-amine.

Molecular Properties

Compound Name8-(11-phenylbenzo[b]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-3-amine;8-(7-phenylbenzo[c]fluoren-7-yl)-N,N-bis(4-phenylphenyl)dibenzothiophen-4-amine
PubChem CID163609854
Molecular FormulaC118H78N2OS
Molecular Weight1572.00 g/mol
Exact Mass1570.58
IUPAC Name8-(11-phenylbenzo[b]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-3-amine;8-(7-phenylbenzo[c]fluoren-7-yl)-N,N-bis(4-phenylphenyl)dibenzothiophen-4-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)oc3ccc(C5(c6ccccc6)c6ccccc6-c6cc7ccccc7cc65)cc34)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc4c3sc3ccc(C5(c6ccccc6)c6ccccc6-c6c5ccc5ccccc65)cc34)cc2)cc1
InChIInChI=1S/C59H39NO.C59H39NS/c1-4-14-40(15-5-1)42-24-29-48(30-25-42)60(49-31-26-43(27-32-49)41-16-6-2-7-17-41)50-33-34-52-54-38-47(28-35-57(54)61-58(52)39-50)59(46-20-8-3-9-21-46)55-23-13-12-22-51(55)53-36-44-18-10-11-19-45(44)37-56(53)59;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)55-26-14-24-50-52-39-46(32-38-56(52)61-58(50)55)59(45-20-8-3-9-21-45)53-25-13-12-23-51(53)57-49-22-11-10-19-44(49)31-37-54(57)59/h2*1-39H
InChIKeyHEYXSEAFXMNCQW-UHFFFAOYSA-N
XLogP32.28
TPSA19.62 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms122
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001572.00
LogP ≤ 532.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 8-(11-phenylbenzo[b]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-3-amine;8-(7-phenylbenzo[c]fluoren-7-yl)-N,N-bis(4-phenylphenyl)dibenzothiophen-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-dibenzofuran-3-yl-N-phenyl-8-(11-phenylbenzo[b]fluoren-11-yl)dibenzofuran-3-amine;7-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)dibenzothiophen-2-amine;N-phenyl-N-[9-(9-phenylfluoren-9-yl)dibenzothiophen-4-yl]dibenzofuran-3-amine
CID 163560828
N-dibenzothiophen-2-yl-N-spiro[benzo[g]fluorene-7,9'-thioxanthene]-9-yldibenzofuran-2-amine;N-dibenzothiophen-3-yl-N-spiro[benzo[g]fluorene-7,9'-thioxanthene]-9-yldibenzofuran-3-amine;N-dibenzothiophen-4-yl-N-spiro[benzo[g]fluorene-7,9'-thioxanthene]-9-yldibenzofuran-4-amine;N-phenyl-N-(4-phenylphenyl)spiro[benzo[b]fluorene-11,9'-thioxanthene]-2-amine
CID 164992700
N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-N-(9,9-diphenylfluoren-3-yl)dibenzothiophen-4-amine
CID 121424914
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-phenyl-8-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzothiophen-4-amine
CID 163549331
N,N-bis(9,9-dimethylfluoren-2-yl)-8-(9-phenylfluoren-9-yl)dibenzofuran-3-amine;N-[4-[7-(9-phenylfluoren-9-yl)dibenzofuran-2-yl]phenyl]-N-(3-phenylphenyl)dibenzothiophen-4-amine
CID 163533094
N-(7-carbazol-9-yl-9,9-diphenylfluoren-2-yl)-N-dibenzothiophen-4-yldibenzofuran-3-amine;N-(7-carbazol-9-yl-9,9-diphenylfluoren-2-yl)-N-phenyldibenzothiophen-2-amine;N-[3-(2-carbazol-9-yl-9-phenylfluoren-9-yl)phenyl]-N-(3-phenylphenyl)naphthalen-1-amine
CID 167586364
N-dibenzofuran-3-yl-N-[4-[3-(9-phenylfluoren-9-yl)phenyl]phenyl]dibenzofuran-3-amine;N-phenyl-N-[4-[3-(9-phenylfluoren-9-yl)phenyl]phenyl]dibenzofuran-4-amine;N-phenyl-N-[4-[3-(9-phenylfluoren-9-yl)phenyl]phenyl]dibenzothiophen-4-amine
CID 159394304
N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]phenanthren-2-amine;N-phenanthren-2-yl-N-[4-(9-phenylfluoren-9-yl)phenyl]dibenzothiophen-2-amine;N-phenanthren-2-yl-N-[4-(9-phenylfluoren-9-yl)phenyl]dibenzothiophen-4-amine
CID 158532816
N-[4-(3-dibenzofuran-2-ylphenyl)phenyl]-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-4-amine
CID 121424368
N-dibenzothiophen-4-yl-6-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-3-amine
CID 169021968
N-dibenzofuran-3-yl-N-[4-(12-phenylnaphtho[1,2-b]indolizin-4-yl)phenyl]dibenzofuran-3-amine;N-naphthalen-2-yl-9,9-diphenyl-N-[4-(12-phenylnaphtho[1,2-b]indolizin-4-yl)phenyl]fluoren-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(12-phenylnaphtho[1,2-b]indolizin-4-yl)phenyl]dibenzothiophen-4-amine;4-phenyl-N-[4-(12-phenylnaphtho[1,2-b]indolizin-4-yl)phenyl]-N-(4-phenylphenyl)aniline
CID 159943101

Frequently Asked Questions

What is the IUPAC name of 8-(11-phenylbenzo[b]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-3-amine;8-(7-phenylbenzo[c]fluoren-7-yl)-N,N-bis(4-phenylphenyl)dibenzothiophen-4-amine?
The IUPAC name of 8-(11-phenylbenzo[b]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-3-amine;8-(7-phenylbenzo[c]fluoren-7-yl)-N,N-bis(4-phenylphenyl)dibenzothiophen-4-amine (CID 163609854) is 8-(11-phenylbenzo[b]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-3-amine;8-(7-phenylbenzo[c]fluoren-7-yl)-N,N-bis(4-phenylphenyl)dibenzothiophen-4-amine.
What is the SMILES notation for 8-(11-phenylbenzo[b]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-3-amine;8-(7-phenylbenzo[c]fluoren-7-yl)-N,N-bis(4-phenylphenyl)dibenzothiophen-4-amine?
The canonical SMILES for 8-(11-phenylbenzo[b]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-3-amine;8-(7-phenylbenzo[c]fluoren-7-yl)-N,N-bis(4-phenylphenyl)dibenzothiophen-4-amine is c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)oc3ccc(C5(c6ccccc6)c6ccccc6-c6cc7ccccc7cc65)cc34)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc4c3sc3ccc(C5(c6ccccc6)c6ccccc6-c6c5ccc5ccccc65)cc34)cc2)cc1.
What is the InChIKey of 8-(11-phenylbenzo[b]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-3-amine;8-(7-phenylbenzo[c]fluoren-7-yl)-N,N-bis(4-phenylphenyl)dibenzothiophen-4-amine?
The InChIKey is HEYXSEAFXMNCQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H39NO.C59H39NS/c1-4-14-40(15-5-1)42-24-29-48(30-25-42)60(49-31-26-43(27-32-49)41-16-6-2-7-17-41)50-33-34-52-54-38-47(28-35-57(54)61-58(52)39-50)59(46-20-8-3-9-21-46)55-23-13-12-22-51(55)53-36-44-18-10-11-19-45(44)37-56(53)59;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)55-26-14-24-50-52-39-46(32-38-56(52)61-58(50)55)59(45-20-8-3-9-21-45)53-25-13-12-23-51(53)57-49-22-11-10-19-44(49)31-37-54(57)59/h2*1-39H.
What are the key properties of 8-(11-phenylbenzo[b]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-3-amine;8-(7-phenylbenzo[c]fluoren-7-yl)-N,N-bis(4-phenylphenyl)dibenzothiophen-4-amine?
8-(11-phenylbenzo[b]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-3-amine;8-(7-phenylbenzo[c]fluoren-7-yl)-N,N-bis(4-phenylphenyl)dibenzothiophen-4-amine has a molecular weight of 1572.00 g/mol, XLogP of 32.28, 14 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(11-phenylbenzo[b]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-3-amine;8-(7-phenylbenzo[c]fluoren-7-yl)-N,N-bis(4-phenylphenyl)dibenzothiophen-4-amine is sourced from PubChem (CID 163609854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).