4-(2-tert-butyl-3-dibenzothiophen-4-ylphenyl)dibenzofuran;1-[2-tert-butyl-3-(9H-fluoren-4-yl)phenyl]dibenzothiophene;1-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butyl-3-phenylphenyl)dibenzothiophene;1-(2,3-ditert-butylphenyl)dibenzothiophene;4-(2,3-ditert-butylphenyl)dibenzothiophene

C193H174OS7 — CID 162086898

IUPAC4-(2-tert-butyl-3-dibenzothiophen-4-ylphenyl)dibenzofuran;1-[2-tert-butyl-3-(9H-fluoren-4-yl)phenyl]dibenzothiophene;1-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butyl-3-phenylphenyl)dibenzothiophene;1-(2,3-ditert-butylphenyl)dibenzothiophene;4-(2,3-ditert-butylphenyl)dibenzothiophene
SMILESCC(C)(C)c1c(-c2cccc3c2-c2ccccc2C3)cccc1-c1cccc2sc3ccccc3c12.CC(C)(C)c1c(-c2cccc3c2oc2ccccc23)cccc1-c1cccc2c1sc1ccccc12.CC(C)(C)c1c(-c2ccccc2)cccc1-c1cccc2c1sc1ccccc12.CC(C)(C)c1cccc(-c2cccc3c2sc2ccccc23)c1C(C)(C)C.CC(C)(C)c1cccc(-c2cccc3sc4ccccc4c23)c1C(C)(C)C.CC(C)(C)c1ccccc1-c1cccc2c1sc1ccccc12.CC(C)(C)c1ccccc1-c1cccc2sc3ccccc3c12
InChIInChI=1S/C35H28S.C34H26OS.C28H24S.2C26H28S.2C22H20S/c1-35(2,3)34-27(25-15-8-12-23-21-22-11-4-5-13-24(22)32(23)25)17-9-18-28(34)26-16-10-20-31-33(26)29-14-6-7-19-30(29)36-31;1-34(2,3)31-23(26-16-9-15-25-21-11-4-6-19-29(21)35-32(25)26)13-8-14-24(31)28-18-10-17-27-22-12-5-7-20-30(22)36-33(27)28;1-28(2,3)26-20(19-11-5-4-6-12-19)14-9-15-22(26)24-17-10-16-23-21-13-7-8-18-25(21)29-27(23)24;1-25(2,3)21-15-10-12-18(23(21)26(4,5)6)20-14-9-13-19-17-11-7-8-16-22(17)27-24(19)20;1-25(2,3)20-14-9-13-18(24(20)26(4,5)6)17-12-10-16-22-23(17)19-11-7-8-15-21(19)27-22;1-22(2,3)19-13-6-4-9-15(19)17-11-8-12-18-16-10-5-7-14-20(16)23-21(17)18;1-22(2,3)18-12-6-4-9-15(18)16-11-8-14-20-21(16)17-10-5-7-13-19(17)23-20/h4-20H,21H2,1-3H3;4-20H,1-3H3;4-18H,1-3H3;2*7-16H,1-6H3;2*4-14H,1-3H3
InChIKeyZDBXVHQPSWLLKO-UHFFFAOYSA-N
MW2733.98 g/mol
LogP60.20
Rot. Bonds10

About 4-(2-tert-butyl-3-dibenzothiophen-4-ylphenyl)dibenzofuran;1-[2-tert-butyl-3-(9H-fluoren-4-yl)phenyl]dibenzothiophene;1-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butyl-3-phenylphenyl)dibenzothiophene;1-(2,3-ditert-butylphenyl)dibenzothiophene;4-(2,3-ditert-butylphenyl)dibenzothiophene

4-(2-tert-butyl-3-dibenzothiophen-4-ylphenyl)dibenzofuran;1-[2-tert-butyl-3-(9H-fluoren-4-yl)phenyl]dibenzothiophene;1-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butyl-3-phenylphenyl)dibenzothiophene;1-(2,3-ditert-butylphenyl)dibenzothiophene;4-(2,3-ditert-butylphenyl)dibenzothiophene (PubChem CID 162086898) has the molecular formula C193H174OS7 and a molecular weight of 2733.98 g/mol. Its IUPAC name is 4-(2-tert-butyl-3-dibenzothiophen-4-ylphenyl)dibenzofuran;1-[2-tert-butyl-3-(9H-fluoren-4-yl)phenyl]dibenzothiophene;1-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butyl-3-phenylphenyl)dibenzothiophene;1-(2,3-ditert-butylphenyl)dibenzothiophene;4-(2,3-ditert-butylphenyl)dibenzothiophene.

Molecular Properties

Compound Name4-(2-tert-butyl-3-dibenzothiophen-4-ylphenyl)dibenzofuran;1-[2-tert-butyl-3-(9H-fluoren-4-yl)phenyl]dibenzothiophene;1-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butyl-3-phenylphenyl)dibenzothiophene;1-(2,3-ditert-butylphenyl)dibenzothiophene;4-(2,3-ditert-butylphenyl)dibenzothiophene
PubChem CID162086898
Molecular FormulaC193H174OS7
Molecular Weight2733.98 g/mol
Exact Mass2731.16
IUPAC Name4-(2-tert-butyl-3-dibenzothiophen-4-ylphenyl)dibenzofuran;1-[2-tert-butyl-3-(9H-fluoren-4-yl)phenyl]dibenzothiophene;1-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butyl-3-phenylphenyl)dibenzothiophene;1-(2,3-ditert-butylphenyl)dibenzothiophene;4-(2,3-ditert-butylphenyl)dibenzothiophene
SMILESCC(C)(C)c1c(-c2cccc3c2-c2ccccc2C3)cccc1-c1cccc2sc3ccccc3c12.CC(C)(C)c1c(-c2cccc3c2oc2ccccc23)cccc1-c1cccc2c1sc1ccccc12.CC(C)(C)c1c(-c2ccccc2)cccc1-c1cccc2c1sc1ccccc12.CC(C)(C)c1cccc(-c2cccc3c2sc2ccccc23)c1C(C)(C)C.CC(C)(C)c1cccc(-c2cccc3sc4ccccc4c23)c1C(C)(C)C.CC(C)(C)c1ccccc1-c1cccc2c1sc1ccccc12.CC(C)(C)c1ccccc1-c1cccc2sc3ccccc3c12
InChIInChI=1S/C35H28S.C34H26OS.C28H24S.2C26H28S.2C22H20S/c1-35(2,3)34-27(25-15-8-12-23-21-22-11-4-5-13-24(22)32(23)25)17-9-18-28(34)26-16-10-20-31-33(26)29-14-6-7-19-30(29)36-31;1-34(2,3)31-23(26-16-9-15-25-21-11-4-6-19-29(21)35-32(25)26)13-8-14-24(31)28-18-10-17-27-22-12-5-7-20-30(22)36-33(27)28;1-28(2,3)26-20(19-11-5-4-6-12-19)14-9-15-22(26)24-17-10-16-23-21-13-7-8-18-25(21)29-27(23)24;1-25(2,3)21-15-10-12-18(23(21)26(4,5)6)20-14-9-13-19-17-11-7-8-16-22(17)27-24(19)20;1-25(2,3)20-14-9-13-18(24(20)26(4,5)6)17-12-10-16-22-23(17)19-11-7-8-15-21(19)27-22;1-22(2,3)19-13-6-4-9-15(19)17-11-8-12-18-16-10-5-7-14-20(16)23-21(17)18;1-22(2,3)18-12-6-4-9-15(18)16-11-8-14-20-21(16)17-10-5-7-13-19(17)23-20/h4-20H,21H2,1-3H3;4-20H,1-3H3;4-18H,1-3H3;2*7-16H,1-6H3;2*4-14H,1-3H3
InChIKeyZDBXVHQPSWLLKO-UHFFFAOYSA-N
XLogP60.20
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds10
Heavy Atoms201
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002733.98
LogP ≤ 560.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 4-(2-tert-butyl-3-dibenzothiophen-4-ylphenyl)dibenzofuran;1-[2-tert-butyl-3-(9H-fluoren-4-yl)phenyl]dibenzothiophene;1-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butyl-3-phenylphenyl)dibenzothiophene;1-(2,3-ditert-butylphenyl)dibenzothiophene;4-(2,3-ditert-butylphenyl)dibenzothiophene with MolForge

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Related Compounds

1-[2-tert-butyl-3-(9H-fluoren-4-yl)phenyl]dibenzofuran;1-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butylphenyl)dibenzothiophene;1-(2-tert-butyl-3-phenylphenyl)dibenzothiophene;4-(2-tert-butyl-3-phenylphenyl)dibenzothiophene;1-[2-tert-butyl-3-(2,3,4,6-tetradeuterio-5-methylphenyl)phenyl]dibenzothiophene;4-[2-tert-butyl-3-(2,3,4,6-tetradeuterio-5-methylphenyl)phenyl]dibenzothiophene
CID 165089400
4-(2-tert-butyl-3-dibenzofuran-4-ylphenyl)dibenzofuran;1-[2-tert-butyl-3-(9H-fluoren-4-yl)phenyl]dibenzofuran
CID 161275768
1-tert-butyl-9-(3,5-ditert-butylphenyl)dibenzothiophene;1-(2-tert-butylphenyl)dibenzofuran;4-(2-tert-butylphenyl)dibenzofuran;1-(2-tert-butyl-3-phenylphenyl)dibenzofuran;4-(2-tert-butyl-3-phenylphenyl)dibenzofuran
CID 165087419
4-(2-tert-butyl-3-phenylphenyl)dibenzothiophene
CID 146578977
2-(2-dibenzofuran-4-yl-6-dibenzothiophen-1-ylphenyl)-4,6-diphenyl-1,3,5-triazine
CID 171402570
2-dibenzofuran-4-yl-4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)-6-phenyl-1,3,5-triazine
CID 155077964
2-dibenzofuran-4-yl-4-(9-dibenzothiophen-4-yldibenzofuran-1-yl)-6-phenyl-1,3,5-triazine
CID 166952530
N-[4-(2-dibenzofuran-4-ylphenyl)phenyl]-N-(4-dibenzothiophen-4-ylphenyl)-4-phenylaniline
CID 154961714
2-tert-butyl-5,19-diphenyl-10,14-dioxapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4,6,8,11,15,17,19-nonaene;4-tert-butyl-3-(2,3,4,5,6-pentadeuteriophenyl)dibenzofuran;1-tert-butyl-2-phenyldibenzofuran;4-tert-butyl-3-phenyldibenzofuran;1-tert-butyl-2-phenyldibenzothiophene;4-tert-butyl-3-phenyldibenzothiophene
CID 160942218
1-(2-tert-butylphenyl)-7-[2-[2-dibenzofuran-4-yl-4-[2-(2-dibenzofuran-1-yl-6-phenylphenyl)-2-methylpropyl]-6-phenylphenyl]-2-methylpropyl]dibenzofuran
CID 167289333
2-dibenzofuran-4-yl-4-(6-dibenzofuran-4-yldibenzothiophen-3-yl)-6-phenyl-1,3,5-triazine;2-dibenzothiophen-1-yl-4-(9-dibenzothiophen-4-yldibenzofuran-3-yl)-6-phenyl-1,3,5-triazine;2-dibenzothiophen-2-yl-4-(9-dibenzothiophen-4-yldibenzofuran-3-yl)-6-phenyl-1,3,5-triazine
CID 159808130
1-tert-butyl-2-phenyldibenzofuran;4-tert-butyl-3-phenyldibenzofuran;1-tert-butyl-2-phenyldibenzothiophene;4-tert-butyl-3-phenyldibenzothiophene;1-tert-butyl-2-(2,3,5,6-tetradeuterio-4-methylphenyl)dibenzofuran;4-tert-butyl-3-(2,3,5,6-tetradeuterio-4-methylphenyl)dibenzofuran;4-tert-butyl-3-(2,3,5,6-tetradeuterio-4-methylphenyl)dibenzothiophene
CID 158935638

Frequently Asked Questions

What is the IUPAC name of 4-(2-tert-butyl-3-dibenzothiophen-4-ylphenyl)dibenzofuran;1-[2-tert-butyl-3-(9H-fluoren-4-yl)phenyl]dibenzothiophene;1-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butyl-3-phenylphenyl)dibenzothiophene;1-(2,3-ditert-butylphenyl)dibenzothiophene;4-(2,3-ditert-butylphenyl)dibenzothiophene?
The IUPAC name of 4-(2-tert-butyl-3-dibenzothiophen-4-ylphenyl)dibenzofuran;1-[2-tert-butyl-3-(9H-fluoren-4-yl)phenyl]dibenzothiophene;1-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butyl-3-phenylphenyl)dibenzothiophene;1-(2,3-ditert-butylphenyl)dibenzothiophene;4-(2,3-ditert-butylphenyl)dibenzothiophene (CID 162086898) is 4-(2-tert-butyl-3-dibenzothiophen-4-ylphenyl)dibenzofuran;1-[2-tert-butyl-3-(9H-fluoren-4-yl)phenyl]dibenzothiophene;1-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butyl-3-phenylphenyl)dibenzothiophene;1-(2,3-ditert-butylphenyl)dibenzothiophene;4-(2,3-ditert-butylphenyl)dibenzothiophene.
What is the SMILES notation for 4-(2-tert-butyl-3-dibenzothiophen-4-ylphenyl)dibenzofuran;1-[2-tert-butyl-3-(9H-fluoren-4-yl)phenyl]dibenzothiophene;1-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butyl-3-phenylphenyl)dibenzothiophene;1-(2,3-ditert-butylphenyl)dibenzothiophene;4-(2,3-ditert-butylphenyl)dibenzothiophene?
The canonical SMILES for 4-(2-tert-butyl-3-dibenzothiophen-4-ylphenyl)dibenzofuran;1-[2-tert-butyl-3-(9H-fluoren-4-yl)phenyl]dibenzothiophene;1-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butyl-3-phenylphenyl)dibenzothiophene;1-(2,3-ditert-butylphenyl)dibenzothiophene;4-(2,3-ditert-butylphenyl)dibenzothiophene is CC(C)(C)c1c(-c2cccc3c2-c2ccccc2C3)cccc1-c1cccc2sc3ccccc3c12.CC(C)(C)c1c(-c2cccc3c2oc2ccccc23)cccc1-c1cccc2c1sc1ccccc12.CC(C)(C)c1c(-c2ccccc2)cccc1-c1cccc2c1sc1ccccc12.CC(C)(C)c1cccc(-c2cccc3c2sc2ccccc23)c1C(C)(C)C.CC(C)(C)c1cccc(-c2cccc3sc4ccccc4c23)c1C(C)(C)C.CC(C)(C)c1ccccc1-c1cccc2c1sc1ccccc12.CC(C)(C)c1ccccc1-c1cccc2sc3ccccc3c12.
What is the InChIKey of 4-(2-tert-butyl-3-dibenzothiophen-4-ylphenyl)dibenzofuran;1-[2-tert-butyl-3-(9H-fluoren-4-yl)phenyl]dibenzothiophene;1-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butyl-3-phenylphenyl)dibenzothiophene;1-(2,3-ditert-butylphenyl)dibenzothiophene;4-(2,3-ditert-butylphenyl)dibenzothiophene?
The InChIKey is ZDBXVHQPSWLLKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H28S.C34H26OS.C28H24S.2C26H28S.2C22H20S/c1-35(2,3)34-27(25-15-8-12-23-21-22-11-4-5-13-24(22)32(23)25)17-9-18-28(34)26-16-10-20-31-33(26)29-14-6-7-19-30(29)36-31;1-34(2,3)31-23(26-16-9-15-25-21-11-4-6-19-29(21)35-32(25)26)13-8-14-24(31)28-18-10-17-27-22-12-5-7-20-30(22)36-33(27)28;1-28(2,3)26-20(19-11-5-4-6-12-19)14-9-15-22(26)24-17-10-16-23-21-13-7-8-18-25(21)29-27(23)24;1-25(2,3)21-15-10-12-18(23(21)26(4,5)6)20-14-9-13-19-17-11-7-8-16-22(17)27-24(19)20;1-25(2,3)20-14-9-13-18(24(20)26(4,5)6)17-12-10-16-22-23(17)19-11-7-8-15-21(19)27-22;1-22(2,3)19-13-6-4-9-15(19)17-11-8-12-18-16-10-5-7-14-20(16)23-21(17)18;1-22(2,3)18-12-6-4-9-15(18)16-11-8-14-20-21(16)17-10-5-7-13-19(17)23-20/h4-20H,21H2,1-3H3;4-20H,1-3H3;4-18H,1-3H3;2*7-16H,1-6H3;2*4-14H,1-3H3.
What are the key properties of 4-(2-tert-butyl-3-dibenzothiophen-4-ylphenyl)dibenzofuran;1-[2-tert-butyl-3-(9H-fluoren-4-yl)phenyl]dibenzothiophene;1-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butyl-3-phenylphenyl)dibenzothiophene;1-(2,3-ditert-butylphenyl)dibenzothiophene;4-(2,3-ditert-butylphenyl)dibenzothiophene?
4-(2-tert-butyl-3-dibenzothiophen-4-ylphenyl)dibenzofuran;1-[2-tert-butyl-3-(9H-fluoren-4-yl)phenyl]dibenzothiophene;1-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butyl-3-phenylphenyl)dibenzothiophene;1-(2,3-ditert-butylphenyl)dibenzothiophene;4-(2,3-ditert-butylphenyl)dibenzothiophene has a molecular weight of 2733.98 g/mol, XLogP of 60.20, 10 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-tert-butyl-3-dibenzothiophen-4-ylphenyl)dibenzofuran;1-[2-tert-butyl-3-(9H-fluoren-4-yl)phenyl]dibenzothiophene;1-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butylphenyl)dibenzothiophene;4-(2-tert-butyl-3-phenylphenyl)dibenzothiophene;1-(2,3-ditert-butylphenyl)dibenzothiophene;4-(2,3-ditert-butylphenyl)dibenzothiophene is sourced from PubChem (CID 162086898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).