2-tert-butyl-3-dibenzofuran-2-ylquinoxaline;2-tert-butyl-3-dibenzofuran-4-ylquinoxaline;2-tert-butyl-3-dibenzothiophen-2-ylquinoxaline;2-tert-butyl-3-(4-naphthalen-2-ylphenyl)quinoxaline;2-tert-butyl-3-naphthalen-2-ylquinoxaline;2-tert-butyl-3-(4-phenylphenyl)quinoxaline

C146H126N12O2S — CID 163968463

IUPAC2-tert-butyl-3-dibenzofuran-2-ylquinoxaline;2-tert-butyl-3-dibenzofuran-4-ylquinoxaline;2-tert-butyl-3-dibenzothiophen-2-ylquinoxaline;2-tert-butyl-3-(4-naphthalen-2-ylphenyl)quinoxaline;2-tert-butyl-3-naphthalen-2-ylquinoxaline;2-tert-butyl-3-(4-phenylphenyl)quinoxaline
SMILESCC(C)(C)c1nc2ccccc2nc1-c1ccc(-c2ccc3ccccc3c2)cc1.CC(C)(C)c1nc2ccccc2nc1-c1ccc(-c2ccccc2)cc1.CC(C)(C)c1nc2ccccc2nc1-c1ccc2ccccc2c1.CC(C)(C)c1nc2ccccc2nc1-c1ccc2oc3ccccc3c2c1.CC(C)(C)c1nc2ccccc2nc1-c1ccc2sc3ccccc3c2c1.CC(C)(C)c1nc2ccccc2nc1-c1cccc2c1oc1ccccc12
InChIInChI=1S/C28H24N2.2C24H20N2O.C24H20N2S.C24H22N2.C22H20N2/c1-28(2,3)27-26(29-24-10-6-7-11-25(24)30-27)21-15-12-20(13-16-21)23-17-14-19-8-4-5-9-22(19)18-23;1-24(2,3)23-21(25-18-12-5-6-13-19(18)26-23)17-11-8-10-16-15-9-4-7-14-20(15)27-22(16)17;2*1-24(2,3)23-22(25-18-9-5-6-10-19(18)26-23)15-12-13-21-17(14-15)16-8-4-7-11-20(16)27-21;1-24(2,3)23-22(25-20-11-7-8-12-21(20)26-23)19-15-13-18(14-16-19)17-9-5-4-6-10-17;1-22(2,3)21-20(23-18-10-6-7-11-19(18)24-21)17-13-12-15-8-4-5-9-16(15)14-17/h4-18H,1-3H3;3*4-14H,1-3H3;4-16H,1-3H3;4-14H,1-3H3
InChIKeySNWWHKFVQSOSHX-UHFFFAOYSA-N
MW2112.76 g/mol
LogP39.37
Rot. Bonds8

About 2-tert-butyl-3-dibenzofuran-2-ylquinoxaline;2-tert-butyl-3-dibenzofuran-4-ylquinoxaline;2-tert-butyl-3-dibenzothiophen-2-ylquinoxaline;2-tert-butyl-3-(4-naphthalen-2-ylphenyl)quinoxaline;2-tert-butyl-3-naphthalen-2-ylquinoxaline;2-tert-butyl-3-(4-phenylphenyl)quinoxaline

2-tert-butyl-3-dibenzofuran-2-ylquinoxaline;2-tert-butyl-3-dibenzofuran-4-ylquinoxaline;2-tert-butyl-3-dibenzothiophen-2-ylquinoxaline;2-tert-butyl-3-(4-naphthalen-2-ylphenyl)quinoxaline;2-tert-butyl-3-naphthalen-2-ylquinoxaline;2-tert-butyl-3-(4-phenylphenyl)quinoxaline (PubChem CID 163968463) has the molecular formula C146H126N12O2S and a molecular weight of 2112.76 g/mol. Its IUPAC name is 2-tert-butyl-3-dibenzofuran-2-ylquinoxaline;2-tert-butyl-3-dibenzofuran-4-ylquinoxaline;2-tert-butyl-3-dibenzothiophen-2-ylquinoxaline;2-tert-butyl-3-(4-naphthalen-2-ylphenyl)quinoxaline;2-tert-butyl-3-naphthalen-2-ylquinoxaline;2-tert-butyl-3-(4-phenylphenyl)quinoxaline.

Molecular Properties

Compound Name2-tert-butyl-3-dibenzofuran-2-ylquinoxaline;2-tert-butyl-3-dibenzofuran-4-ylquinoxaline;2-tert-butyl-3-dibenzothiophen-2-ylquinoxaline;2-tert-butyl-3-(4-naphthalen-2-ylphenyl)quinoxaline;2-tert-butyl-3-naphthalen-2-ylquinoxaline;2-tert-butyl-3-(4-phenylphenyl)quinoxaline
PubChem CID163968463
Molecular FormulaC146H126N12O2S
Molecular Weight2112.76 g/mol
Exact Mass2110.98
IUPAC Name2-tert-butyl-3-dibenzofuran-2-ylquinoxaline;2-tert-butyl-3-dibenzofuran-4-ylquinoxaline;2-tert-butyl-3-dibenzothiophen-2-ylquinoxaline;2-tert-butyl-3-(4-naphthalen-2-ylphenyl)quinoxaline;2-tert-butyl-3-naphthalen-2-ylquinoxaline;2-tert-butyl-3-(4-phenylphenyl)quinoxaline
SMILESCC(C)(C)c1nc2ccccc2nc1-c1ccc(-c2ccc3ccccc3c2)cc1.CC(C)(C)c1nc2ccccc2nc1-c1ccc(-c2ccccc2)cc1.CC(C)(C)c1nc2ccccc2nc1-c1ccc2ccccc2c1.CC(C)(C)c1nc2ccccc2nc1-c1ccc2oc3ccccc3c2c1.CC(C)(C)c1nc2ccccc2nc1-c1ccc2sc3ccccc3c2c1.CC(C)(C)c1nc2ccccc2nc1-c1cccc2c1oc1ccccc12
InChIInChI=1S/C28H24N2.2C24H20N2O.C24H20N2S.C24H22N2.C22H20N2/c1-28(2,3)27-26(29-24-10-6-7-11-25(24)30-27)21-15-12-20(13-16-21)23-17-14-19-8-4-5-9-22(19)18-23;1-24(2,3)23-21(25-18-12-5-6-13-19(18)26-23)17-11-8-10-16-15-9-4-7-14-20(15)27-22(16)17;2*1-24(2,3)23-22(25-18-9-5-6-10-19(18)26-23)15-12-13-21-17(14-15)16-8-4-7-11-20(16)27-21;1-24(2,3)23-22(25-20-11-7-8-12-21(20)26-23)19-15-13-18(14-16-19)17-9-5-4-6-10-17;1-22(2,3)21-20(23-18-10-6-7-11-19(18)24-21)17-13-12-15-8-4-5-9-16(15)14-17/h4-18H,1-3H3;3*4-14H,1-3H3;4-16H,1-3H3;4-14H,1-3H3
InChIKeySNWWHKFVQSOSHX-UHFFFAOYSA-N
XLogP39.37
TPSA180.96 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds8
Heavy Atoms161
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002112.76
LogP ≤ 539.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 2-tert-butyl-3-dibenzofuran-2-ylquinoxaline;2-tert-butyl-3-dibenzofuran-4-ylquinoxaline;2-tert-butyl-3-dibenzothiophen-2-ylquinoxaline;2-tert-butyl-3-(4-naphthalen-2-ylphenyl)quinoxaline;2-tert-butyl-3-naphthalen-2-ylquinoxaline;2-tert-butyl-3-(4-phenylphenyl)quinoxaline with MolForge

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Related Compounds

6-dibenzothiophen-2-yl-2-[3-(4-phenylphenyl)phenyl]dibenzofuran
CID 118349956
4-(3-dibenzofuran-4-yl-5-naphthalen-2-ylphenyl)-6-dibenzothiophen-2-yl-2-phenylpyrimidine
CID 171583346
2-dibenzothiophen-2-yl-3-(4-naphthalen-2-ylphenyl)quinoxaline
CID 164956800
2-dibenzofuran-4-yl-4-(3-methylphenyl)-6-phenyl-1,3,5-triazine;2-dibenzofuran-1-yl-4-methyl-6-phenyl-1,3,5-triazine;2-dibenzofuran-2-yl-4-methyl-6-phenyl-1,3,5-triazine;2-dibenzofuran-4-yl-4-methyl-6-phenyl-1,3,5-triazine;2-dibenzothiophen-2-yl-4-methyl-6-phenyl-1,3,5-triazine;2-methyl-4,6-diphenyl-1,3,5-triazine;2-methyl-4-naphthalen-2-ylquinazoline
CID 167602509
8-[4-[4-(4-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenyl-[1]benzothiolo[3,2-c]quinoline;8-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-6-naphthalen-2-yl-[1]benzothiolo[3,2-c]quinoline;8-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-6-phenyl-[1]benzothiolo[3,2-c]quinoline;8-[4-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-6-phenyl-[1]benzothiolo[3,2-c]quinoline
CID 163415221
2-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran;2-[3-(10-phenanthren-2-ylanthracen-9-yl)phenyl]dibenzofuran;4-[4-(10-phenanthren-3-ylanthracen-9-yl)phenyl]dibenzofuran;2-[3-(10-phenanthren-2-ylanthracen-9-yl)phenyl]dibenzothiophene;2-[4-(10-phenanthren-2-ylanthracen-9-yl)phenyl]dibenzothiophene;4-[4-(10-phenanthren-2-ylanthracen-9-yl)phenyl]dibenzothiophene
CID 160693939
N-(4-dibenzofuran-4-ylphenyl)-3-dibenzothiophen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline
CID 168767541
3-dibenzofuran-3-yl-6-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-4-yl-6-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzothiophen-2-yl-6-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole
CID 164995701
4-dibenzofuran-2-yl-6-(3-dibenzothiophen-2-yl-5-naphthalen-2-ylphenyl)-2-phenylpyrimidine
CID 171585383
2-dibenzofuran-4-yl-4-(3-dibenzothiophen-2-yl-5-phenylphenyl)-6-phenylpyrimidine
CID 171585439
2-(5-naphthalen-2-ylnaphtho[1,2-b][1]benzofuran-8-yl)-3-phenylquinoxaline
CID 176817926
2-[2-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzothiophene;2-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzothiophene;2-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzothiophene;4-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzothiophene;4-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzothiophene;2-[6-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphthalen-2-yl]dibenzofuran;4-[6-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphthalen-2-yl]dibenzofuran;4-[3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzothiophene;4-[4-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzothiophene;4-[4-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzothiophene
CID 158929637

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-3-dibenzofuran-2-ylquinoxaline;2-tert-butyl-3-dibenzofuran-4-ylquinoxaline;2-tert-butyl-3-dibenzothiophen-2-ylquinoxaline;2-tert-butyl-3-(4-naphthalen-2-ylphenyl)quinoxaline;2-tert-butyl-3-naphthalen-2-ylquinoxaline;2-tert-butyl-3-(4-phenylphenyl)quinoxaline?
The IUPAC name of 2-tert-butyl-3-dibenzofuran-2-ylquinoxaline;2-tert-butyl-3-dibenzofuran-4-ylquinoxaline;2-tert-butyl-3-dibenzothiophen-2-ylquinoxaline;2-tert-butyl-3-(4-naphthalen-2-ylphenyl)quinoxaline;2-tert-butyl-3-naphthalen-2-ylquinoxaline;2-tert-butyl-3-(4-phenylphenyl)quinoxaline (CID 163968463) is 2-tert-butyl-3-dibenzofuran-2-ylquinoxaline;2-tert-butyl-3-dibenzofuran-4-ylquinoxaline;2-tert-butyl-3-dibenzothiophen-2-ylquinoxaline;2-tert-butyl-3-(4-naphthalen-2-ylphenyl)quinoxaline;2-tert-butyl-3-naphthalen-2-ylquinoxaline;2-tert-butyl-3-(4-phenylphenyl)quinoxaline.
What is the SMILES notation for 2-tert-butyl-3-dibenzofuran-2-ylquinoxaline;2-tert-butyl-3-dibenzofuran-4-ylquinoxaline;2-tert-butyl-3-dibenzothiophen-2-ylquinoxaline;2-tert-butyl-3-(4-naphthalen-2-ylphenyl)quinoxaline;2-tert-butyl-3-naphthalen-2-ylquinoxaline;2-tert-butyl-3-(4-phenylphenyl)quinoxaline?
The canonical SMILES for 2-tert-butyl-3-dibenzofuran-2-ylquinoxaline;2-tert-butyl-3-dibenzofuran-4-ylquinoxaline;2-tert-butyl-3-dibenzothiophen-2-ylquinoxaline;2-tert-butyl-3-(4-naphthalen-2-ylphenyl)quinoxaline;2-tert-butyl-3-naphthalen-2-ylquinoxaline;2-tert-butyl-3-(4-phenylphenyl)quinoxaline is CC(C)(C)c1nc2ccccc2nc1-c1ccc(-c2ccc3ccccc3c2)cc1.CC(C)(C)c1nc2ccccc2nc1-c1ccc(-c2ccccc2)cc1.CC(C)(C)c1nc2ccccc2nc1-c1ccc2ccccc2c1.CC(C)(C)c1nc2ccccc2nc1-c1ccc2oc3ccccc3c2c1.CC(C)(C)c1nc2ccccc2nc1-c1ccc2sc3ccccc3c2c1.CC(C)(C)c1nc2ccccc2nc1-c1cccc2c1oc1ccccc12.
What is the InChIKey of 2-tert-butyl-3-dibenzofuran-2-ylquinoxaline;2-tert-butyl-3-dibenzofuran-4-ylquinoxaline;2-tert-butyl-3-dibenzothiophen-2-ylquinoxaline;2-tert-butyl-3-(4-naphthalen-2-ylphenyl)quinoxaline;2-tert-butyl-3-naphthalen-2-ylquinoxaline;2-tert-butyl-3-(4-phenylphenyl)quinoxaline?
The InChIKey is SNWWHKFVQSOSHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H24N2.2C24H20N2O.C24H20N2S.C24H22N2.C22H20N2/c1-28(2,3)27-26(29-24-10-6-7-11-25(24)30-27)21-15-12-20(13-16-21)23-17-14-19-8-4-5-9-22(19)18-23;1-24(2,3)23-21(25-18-12-5-6-13-19(18)26-23)17-11-8-10-16-15-9-4-7-14-20(15)27-22(16)17;2*1-24(2,3)23-22(25-18-9-5-6-10-19(18)26-23)15-12-13-21-17(14-15)16-8-4-7-11-20(16)27-21;1-24(2,3)23-22(25-20-11-7-8-12-21(20)26-23)19-15-13-18(14-16-19)17-9-5-4-6-10-17;1-22(2,3)21-20(23-18-10-6-7-11-19(18)24-21)17-13-12-15-8-4-5-9-16(15)14-17/h4-18H,1-3H3;3*4-14H,1-3H3;4-16H,1-3H3;4-14H,1-3H3.
What are the key properties of 2-tert-butyl-3-dibenzofuran-2-ylquinoxaline;2-tert-butyl-3-dibenzofuran-4-ylquinoxaline;2-tert-butyl-3-dibenzothiophen-2-ylquinoxaline;2-tert-butyl-3-(4-naphthalen-2-ylphenyl)quinoxaline;2-tert-butyl-3-naphthalen-2-ylquinoxaline;2-tert-butyl-3-(4-phenylphenyl)quinoxaline?
2-tert-butyl-3-dibenzofuran-2-ylquinoxaline;2-tert-butyl-3-dibenzofuran-4-ylquinoxaline;2-tert-butyl-3-dibenzothiophen-2-ylquinoxaline;2-tert-butyl-3-(4-naphthalen-2-ylphenyl)quinoxaline;2-tert-butyl-3-naphthalen-2-ylquinoxaline;2-tert-butyl-3-(4-phenylphenyl)quinoxaline has a molecular weight of 2112.76 g/mol, XLogP of 39.37, 8 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-3-dibenzofuran-2-ylquinoxaline;2-tert-butyl-3-dibenzofuran-4-ylquinoxaline;2-tert-butyl-3-dibenzothiophen-2-ylquinoxaline;2-tert-butyl-3-(4-naphthalen-2-ylphenyl)quinoxaline;2-tert-butyl-3-naphthalen-2-ylquinoxaline;2-tert-butyl-3-(4-phenylphenyl)quinoxaline is sourced from PubChem (CID 163968463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).