2-(4-dibenzothiophen-1-ylnaphthalen-1-yl)-3-phenylquinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(9,9-dimethylfluoren-2-yl)quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)quinoxaline;2-dibenzothiophen-1-yl-3-(4-phenylphenyl)quinoxaline

C147H94N8S4 — CID 165060519

IUPAC2-(4-dibenzothiophen-1-ylnaphthalen-1-yl)-3-phenylquinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(9,9-dimethylfluoren-2-yl)quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)quinoxaline;2-dibenzothiophen-1-yl-3-(4-phenylphenyl)quinoxaline
SMILESCC1(C)c2ccccc2-c2ccc(-c3nc4ccccc4nc3-c3ccc(-c4cccc5sc6ccccc6c45)cc3)cc21.c1ccc(-c2ccc(-c3nc4ccccc4nc3-c3ccc(-c4cccc5sc6ccccc6c45)cc3)cc2)cc1.c1ccc(-c2ccc(-c3nc4ccccc4nc3-c3cccc4sc5ccccc5c34)cc2)cc1.c1ccc(-c2nc3ccccc3nc2-c2ccc(-c3cccc4sc5ccccc5c34)c3ccccc23)cc1
InChIInChI=1S/C41H28N2S.C38H24N2S.C36H22N2S.C32H20N2S/c1-41(2)32-13-5-3-10-29(32)30-23-22-27(24-33(30)41)40-39(42-34-14-6-7-15-35(34)43-40)26-20-18-25(19-21-26)28-12-9-17-37-38(28)31-11-4-8-16-36(31)44-37;1-2-9-25(10-3-1)26-17-21-28(22-18-26)37-38(40-33-14-6-5-13-32(33)39-37)29-23-19-27(20-24-29)30-12-8-16-35-36(30)31-11-4-7-15-34(31)41-35;1-2-11-23(12-3-1)35-36(38-31-18-8-7-17-30(31)37-35)28-22-21-26(24-13-4-5-14-25(24)28)27-16-10-20-33-34(27)29-15-6-9-19-32(29)39-33;1-2-9-21(10-3-1)22-17-19-23(20-18-22)31-32(34-27-14-6-5-13-26(27)33-31)25-12-8-16-29-30(25)24-11-4-7-15-28(24)35-29/h3-24H,1-2H3;1-24H;1-22H;1-20H
InChIKeyRCSCMFFGRURVDH-UHFFFAOYSA-N
MW2100.69 g/mol
LogP41.12
Rot. Bonds13

About 2-(4-dibenzothiophen-1-ylnaphthalen-1-yl)-3-phenylquinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(9,9-dimethylfluoren-2-yl)quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)quinoxaline;2-dibenzothiophen-1-yl-3-(4-phenylphenyl)quinoxaline

2-(4-dibenzothiophen-1-ylnaphthalen-1-yl)-3-phenylquinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(9,9-dimethylfluoren-2-yl)quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)quinoxaline;2-dibenzothiophen-1-yl-3-(4-phenylphenyl)quinoxaline (PubChem CID 165060519) has the molecular formula C147H94N8S4 and a molecular weight of 2100.69 g/mol. Its IUPAC name is 2-(4-dibenzothiophen-1-ylnaphthalen-1-yl)-3-phenylquinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(9,9-dimethylfluoren-2-yl)quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)quinoxaline;2-dibenzothiophen-1-yl-3-(4-phenylphenyl)quinoxaline.

Molecular Properties

Compound Name2-(4-dibenzothiophen-1-ylnaphthalen-1-yl)-3-phenylquinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(9,9-dimethylfluoren-2-yl)quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)quinoxaline;2-dibenzothiophen-1-yl-3-(4-phenylphenyl)quinoxaline
PubChem CID165060519
Molecular FormulaC147H94N8S4
Molecular Weight2100.69 g/mol
Exact Mass2098.65
IUPAC Name2-(4-dibenzothiophen-1-ylnaphthalen-1-yl)-3-phenylquinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(9,9-dimethylfluoren-2-yl)quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)quinoxaline;2-dibenzothiophen-1-yl-3-(4-phenylphenyl)quinoxaline
SMILESCC1(C)c2ccccc2-c2ccc(-c3nc4ccccc4nc3-c3ccc(-c4cccc5sc6ccccc6c45)cc3)cc21.c1ccc(-c2ccc(-c3nc4ccccc4nc3-c3ccc(-c4cccc5sc6ccccc6c45)cc3)cc2)cc1.c1ccc(-c2ccc(-c3nc4ccccc4nc3-c3cccc4sc5ccccc5c34)cc2)cc1.c1ccc(-c2nc3ccccc3nc2-c2ccc(-c3cccc4sc5ccccc5c34)c3ccccc23)cc1
InChIInChI=1S/C41H28N2S.C38H24N2S.C36H22N2S.C32H20N2S/c1-41(2)32-13-5-3-10-29(32)30-23-22-27(24-33(30)41)40-39(42-34-14-6-7-15-35(34)43-40)26-20-18-25(19-21-26)28-12-9-17-37-38(28)31-11-4-8-16-36(31)44-37;1-2-9-25(10-3-1)26-17-21-28(22-18-26)37-38(40-33-14-6-5-13-32(33)39-37)29-23-19-27(20-24-29)30-12-8-16-35-36(30)31-11-4-7-15-34(31)41-35;1-2-11-23(12-3-1)35-36(38-31-18-8-7-17-30(31)37-35)28-22-21-26(24-13-4-5-14-25(24)28)27-16-10-20-33-34(27)29-15-6-9-19-32(29)39-33;1-2-9-21(10-3-1)22-17-19-23(20-18-22)31-32(34-27-14-6-5-13-26(27)33-31)25-12-8-16-29-30(25)24-11-4-7-15-28(24)35-29/h3-24H,1-2H3;1-24H;1-22H;1-20H
InChIKeyRCSCMFFGRURVDH-UHFFFAOYSA-N
XLogP41.12
TPSA103.12 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds13
Heavy Atoms159
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002100.69
LogP ≤ 541.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 2-(4-dibenzothiophen-1-ylnaphthalen-1-yl)-3-phenylquinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(9,9-dimethylfluoren-2-yl)quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)quinoxaline;2-dibenzothiophen-1-yl-3-(4-phenylphenyl)quinoxaline with MolForge

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Related Compounds

2-(4-dibenzothiophen-1-ylphenyl)-3-(9,9-dimethylfluoren-2-yl)quinoxaline
CID 164985271
2-(4-dibenzofuran-1-ylnaphthalen-1-yl)-3-phenylquinoxaline;2-(4-dibenzofuran-1-ylphenyl)-3-(9,9-dimethylfluoren-2-yl)quinoxaline;2-(4-dibenzofuran-1-ylphenyl)-3-(4-phenylphenyl)quinoxaline;2-dibenzofuran-1-yl-3-(4-phenylphenyl)quinoxaline
CID 158835789
1-(9,9-dimethylfluoren-2-yl)dibenzothiophene
CID 145331799
4-(3-dibenzothiophen-1-yl-5-phenylphenyl)-6-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylpyrimidine
CID 171585757
6-[4-[4-[6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidin-4-yl]phenyl]naphthalen-1-yl]-[1]benzothiolo[2,3-c]quinoline;6-[3-[3-[6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidin-4-yl]phenyl]phenyl]-[1]benzothiolo[2,3-c]quinoline
CID 163985838
6-[3-[4-(9,9-dimethylfluoren-2-yl)-6-(3-phenylphenyl)pyrimidin-2-yl]phenyl]-[1]benzothiolo[2,3-c]quinoline;6-[4-[2-(9,9-dimethylfluoren-2-yl)-6-phenylpyrimidin-4-yl]naphthalen-1-yl]-[1]benzothiolo[2,3-c]quinoline;6-[3-[4-(9,9-dimethylfluoren-2-yl)-6-phenylpyrimidin-2-yl]phenyl]-[1]benzothiolo[2,3-c]quinoline;6-[4-[4-[6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidin-4-yl]phenyl]phenyl]-[1]benzothiolo[2,3-c]quinoline
CID 163617081
11-(9,9-dimethylfluoren-2-yl)-14-phenyl-9-thia-15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1,3,5,7,10,12,14,16,18,20-decaene
CID 138513495
14-(9,9-dimethylfluoren-2-yl)-11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9-thia-15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1,3,5,7,10,12,14,16,18,20-decaene
CID 138513055
6-[3-(9,9-dimethylfluoren-3-yl)phenyl]-[1]benzothiolo[3,2-c]quinoline
CID 129134319
N-(2-dibenzothiophen-1-ylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 176583255
2-[1-(9,9-dimethylfluoren-2-yl)dibenzothiophen-4-yl]-4,6-diphenyl-1,3,5-triazine
CID 142491338
2-[1-(9,9-dimethylfluoren-2-yl)dibenzothiophen-4-yl]-4,6-diphenylpyrimidine
CID 142491297

Frequently Asked Questions

What is the IUPAC name of 2-(4-dibenzothiophen-1-ylnaphthalen-1-yl)-3-phenylquinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(9,9-dimethylfluoren-2-yl)quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)quinoxaline;2-dibenzothiophen-1-yl-3-(4-phenylphenyl)quinoxaline?
The IUPAC name of 2-(4-dibenzothiophen-1-ylnaphthalen-1-yl)-3-phenylquinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(9,9-dimethylfluoren-2-yl)quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)quinoxaline;2-dibenzothiophen-1-yl-3-(4-phenylphenyl)quinoxaline (CID 165060519) is 2-(4-dibenzothiophen-1-ylnaphthalen-1-yl)-3-phenylquinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(9,9-dimethylfluoren-2-yl)quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)quinoxaline;2-dibenzothiophen-1-yl-3-(4-phenylphenyl)quinoxaline.
What is the SMILES notation for 2-(4-dibenzothiophen-1-ylnaphthalen-1-yl)-3-phenylquinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(9,9-dimethylfluoren-2-yl)quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)quinoxaline;2-dibenzothiophen-1-yl-3-(4-phenylphenyl)quinoxaline?
The canonical SMILES for 2-(4-dibenzothiophen-1-ylnaphthalen-1-yl)-3-phenylquinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(9,9-dimethylfluoren-2-yl)quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)quinoxaline;2-dibenzothiophen-1-yl-3-(4-phenylphenyl)quinoxaline is CC1(C)c2ccccc2-c2ccc(-c3nc4ccccc4nc3-c3ccc(-c4cccc5sc6ccccc6c45)cc3)cc21.c1ccc(-c2ccc(-c3nc4ccccc4nc3-c3ccc(-c4cccc5sc6ccccc6c45)cc3)cc2)cc1.c1ccc(-c2ccc(-c3nc4ccccc4nc3-c3cccc4sc5ccccc5c34)cc2)cc1.c1ccc(-c2nc3ccccc3nc2-c2ccc(-c3cccc4sc5ccccc5c34)c3ccccc23)cc1.
What is the InChIKey of 2-(4-dibenzothiophen-1-ylnaphthalen-1-yl)-3-phenylquinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(9,9-dimethylfluoren-2-yl)quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)quinoxaline;2-dibenzothiophen-1-yl-3-(4-phenylphenyl)quinoxaline?
The InChIKey is RCSCMFFGRURVDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H28N2S.C38H24N2S.C36H22N2S.C32H20N2S/c1-41(2)32-13-5-3-10-29(32)30-23-22-27(24-33(30)41)40-39(42-34-14-6-7-15-35(34)43-40)26-20-18-25(19-21-26)28-12-9-17-37-38(28)31-11-4-8-16-36(31)44-37;1-2-9-25(10-3-1)26-17-21-28(22-18-26)37-38(40-33-14-6-5-13-32(33)39-37)29-23-19-27(20-24-29)30-12-8-16-35-36(30)31-11-4-7-15-34(31)41-35;1-2-11-23(12-3-1)35-36(38-31-18-8-7-17-30(31)37-35)28-22-21-26(24-13-4-5-14-25(24)28)27-16-10-20-33-34(27)29-15-6-9-19-32(29)39-33;1-2-9-21(10-3-1)22-17-19-23(20-18-22)31-32(34-27-14-6-5-13-26(27)33-31)25-12-8-16-29-30(25)24-11-4-7-15-28(24)35-29/h3-24H,1-2H3;1-24H;1-22H;1-20H.
What are the key properties of 2-(4-dibenzothiophen-1-ylnaphthalen-1-yl)-3-phenylquinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(9,9-dimethylfluoren-2-yl)quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)quinoxaline;2-dibenzothiophen-1-yl-3-(4-phenylphenyl)quinoxaline?
2-(4-dibenzothiophen-1-ylnaphthalen-1-yl)-3-phenylquinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(9,9-dimethylfluoren-2-yl)quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)quinoxaline;2-dibenzothiophen-1-yl-3-(4-phenylphenyl)quinoxaline has a molecular weight of 2100.69 g/mol, XLogP of 41.12, 13 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-dibenzothiophen-1-ylnaphthalen-1-yl)-3-phenylquinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(9,9-dimethylfluoren-2-yl)quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)quinoxaline;2-dibenzothiophen-1-yl-3-(4-phenylphenyl)quinoxaline is sourced from PubChem (CID 165060519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).