7-(3-dibenzofuran-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;7-(3-dibenzothiophen-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;8-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylbenzo[e][1,3]benzothiazole;2-phenyl-7-[3-(4-phenylquinazolin-2-yl)phenyl]benzo[g][1,3]benzoxazole;2-phenyl-7-[3-(3-phenylquinoxalin-2-yl)phenyl]benzo[g][1,3]benzoxazole

C176H108N12O5S2 — CID 160756920

IUPAC7-(3-dibenzofuran-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;7-(3-dibenzothiophen-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;8-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylbenzo[e][1,3]benzothiazole;2-phenyl-7-[3-(4-phenylquinazolin-2-yl)phenyl]benzo[g][1,3]benzoxazole;2-phenyl-7-[3-(3-phenylquinoxalin-2-yl)phenyl]benzo[g][1,3]benzoxazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4ccc5sc(-c6ccccc6)nc5c4c3)n2)cc1.c1ccc(-c2nc3ccc4cc(-c5cccc(-c6cccc7c6oc6ccccc67)c5)ccc4c3o2)cc1.c1ccc(-c2nc3ccc4cc(-c5cccc(-c6cccc7c6sc6ccccc67)c5)ccc4c3o2)cc1.c1ccc(-c2nc3ccc4cc(-c5cccc(-c6nc(-c7ccccc7)c7ccccc7n6)c5)ccc4c3o2)cc1.c1ccc(-c2nc3ccc4cc(-c5cccc(-c6nc7ccccc7nc6-c6ccccc6)c5)ccc4c3o2)cc1
InChIInChI=1S/2C37H23N3O.C35H21NO2.C35H21NOS.C32H20N4S/c1-3-10-24(11-4-1)34-35(39-32-17-8-7-16-31(32)38-34)29-15-9-14-26(23-29)27-18-20-30-28(22-27)19-21-33-36(30)41-37(40-33)25-12-5-2-6-13-25;1-3-10-24(11-4-1)34-31-16-7-8-17-32(31)38-36(40-34)29-15-9-14-26(23-29)27-18-20-30-28(22-27)19-21-33-35(30)41-37(39-33)25-12-5-2-6-13-25;1-2-8-22(9-3-1)35-36-31-19-17-26-21-24(16-18-28(26)34(31)38-35)23-10-6-11-25(20-23)27-13-7-14-30-29-12-4-5-15-32(29)37-33(27)30;1-2-8-22(9-3-1)35-36-31-19-17-26-21-24(16-18-27(26)33(31)37-35)23-10-6-11-25(20-23)28-13-7-14-30-29-12-4-5-15-32(29)38-34(28)30;1-4-10-22(11-5-1)29-34-30(23-12-6-2-7-13-23)36-31(35-29)25-17-16-21-18-19-27-28(26(21)20-25)33-32(37-27)24-14-8-3-9-15-24/h2*1-23H;2*1-21H;1-20H
InChIKeyRXOBNEXDZUQJJK-UHFFFAOYSA-N
MW2535.01 g/mol
LogP47.72
Rot. Bonds18

About 7-(3-dibenzofuran-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;7-(3-dibenzothiophen-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;8-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylbenzo[e][1,3]benzothiazole;2-phenyl-7-[3-(4-phenylquinazolin-2-yl)phenyl]benzo[g][1,3]benzoxazole;2-phenyl-7-[3-(3-phenylquinoxalin-2-yl)phenyl]benzo[g][1,3]benzoxazole

7-(3-dibenzofuran-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;7-(3-dibenzothiophen-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;8-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylbenzo[e][1,3]benzothiazole;2-phenyl-7-[3-(4-phenylquinazolin-2-yl)phenyl]benzo[g][1,3]benzoxazole;2-phenyl-7-[3-(3-phenylquinoxalin-2-yl)phenyl]benzo[g][1,3]benzoxazole (PubChem CID 160756920) has the molecular formula C176H108N12O5S2 and a molecular weight of 2535.01 g/mol. Its IUPAC name is 7-(3-dibenzofuran-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;7-(3-dibenzothiophen-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;8-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylbenzo[e][1,3]benzothiazole;2-phenyl-7-[3-(4-phenylquinazolin-2-yl)phenyl]benzo[g][1,3]benzoxazole;2-phenyl-7-[3-(3-phenylquinoxalin-2-yl)phenyl]benzo[g][1,3]benzoxazole.

Molecular Properties

Compound Name7-(3-dibenzofuran-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;7-(3-dibenzothiophen-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;8-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylbenzo[e][1,3]benzothiazole;2-phenyl-7-[3-(4-phenylquinazolin-2-yl)phenyl]benzo[g][1,3]benzoxazole;2-phenyl-7-[3-(3-phenylquinoxalin-2-yl)phenyl]benzo[g][1,3]benzoxazole
PubChem CID160756920
Molecular FormulaC176H108N12O5S2
Molecular Weight2535.01 g/mol
Exact Mass2532.80
IUPAC Name7-(3-dibenzofuran-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;7-(3-dibenzothiophen-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;8-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylbenzo[e][1,3]benzothiazole;2-phenyl-7-[3-(4-phenylquinazolin-2-yl)phenyl]benzo[g][1,3]benzoxazole;2-phenyl-7-[3-(3-phenylquinoxalin-2-yl)phenyl]benzo[g][1,3]benzoxazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4ccc5sc(-c6ccccc6)nc5c4c3)n2)cc1.c1ccc(-c2nc3ccc4cc(-c5cccc(-c6cccc7c6oc6ccccc67)c5)ccc4c3o2)cc1.c1ccc(-c2nc3ccc4cc(-c5cccc(-c6cccc7c6sc6ccccc67)c5)ccc4c3o2)cc1.c1ccc(-c2nc3ccc4cc(-c5cccc(-c6nc(-c7ccccc7)c7ccccc7n6)c5)ccc4c3o2)cc1.c1ccc(-c2nc3ccc4cc(-c5cccc(-c6nc7ccccc7nc6-c6ccccc6)c5)ccc4c3o2)cc1
InChIInChI=1S/2C37H23N3O.C35H21NO2.C35H21NOS.C32H20N4S/c1-3-10-24(11-4-1)34-35(39-32-17-8-7-16-31(32)38-34)29-15-9-14-26(23-29)27-18-20-30-28(22-27)19-21-33-36(30)41-37(40-33)25-12-5-2-6-13-25;1-3-10-24(11-4-1)34-31-16-7-8-17-32(31)38-36(40-34)29-15-9-14-26(23-29)27-18-20-30-28(22-27)19-21-33-35(30)41-37(39-33)25-12-5-2-6-13-25;1-2-8-22(9-3-1)35-36-31-19-17-26-21-24(16-18-28(26)34(31)38-35)23-10-6-11-25(20-23)27-13-7-14-30-29-12-4-5-15-32(29)37-33(27)30;1-2-8-22(9-3-1)35-36-31-19-17-26-21-24(16-18-27(26)33(31)37-35)23-10-6-11-25(20-23)28-13-7-14-30-29-12-4-5-15-32(29)38-34(28)30;1-4-10-22(11-5-1)29-34-30(23-12-6-2-7-13-23)36-31(35-29)25-17-16-21-18-19-27-28(26(21)20-25)33-32(37-27)24-14-8-3-9-15-24/h2*1-23H;2*1-21H;1-20H
InChIKeyRXOBNEXDZUQJJK-UHFFFAOYSA-N
XLogP47.72
TPSA220.38 Ų
H-Bond Donors
H-Bond Acceptors19
Rotatable Bonds18
Heavy Atoms195
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002535.01
LogP ≤ 547.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1019

Analyze 7-(3-dibenzofuran-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;7-(3-dibenzothiophen-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;8-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylbenzo[e][1,3]benzothiazole;2-phenyl-7-[3-(4-phenylquinazolin-2-yl)phenyl]benzo[g][1,3]benzoxazole;2-phenyl-7-[3-(3-phenylquinoxalin-2-yl)phenyl]benzo[g][1,3]benzoxazole with MolForge

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Related Compounds

8-(3-dibenzothiophen-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;2-phenyl-8-[3-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]benzo[g][1,3]benzoxazole;2-phenyl-8-[3-(4-phenylquinazolin-2-yl)phenyl]benzo[g][1,3]benzoxazole;2-phenyl-8-[3-(3-phenylquinoxalin-2-yl)phenyl]benzo[g][1,3]benzoxazole
CID 160577763
8-dibenzofuran-4-yl-2-phenylbenzo[g][1,3]benzoxazole;8-dibenzothiophen-4-yl-2-phenylbenzo[g][1,3]benzoxazole;8-isoquinolin-1-yl-2-phenylbenzo[g][1,3]benzoxazole;2-phenyl-8-(4-phenylquinazolin-2-yl)benzo[g][1,3]benzoxazole;2-phenyl-8-(3-phenylquinoxalin-2-yl)benzo[g][1,3]benzoxazole
CID 160861066
7-(3-dibenzofuran-4-ylphenyl)-2-phenylbenzo[e][1,3]benzothiazole
CID 138633704
2-(4-dibenzofuran-4-ylphenyl)-4-(3-dibenzothiophen-4-ylphenyl)-6-phenyl-1,3,5-triazine
CID 130288940
2-[4-[6-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]dibenzothiophen-2-yl]phenyl]-1,3-benzothiazole
CID 155356603
2-(3-dibenzofuran-4-ylphenyl)-4-dibenzothiophen-4-yl-6-(4-phenylphenyl)-1,3,5-triazine
CID 171445309
2-(3-dibenzofuran-4-ylphenyl)-4,6-diphenyl-1,3,5-triazine;2-dibenzothiophen-4-yl-4,6-diphenyl-1,3,5-triazine
CID 144953430
2-dibenzothiophen-4-yl-8-(4,6-diphenyl-1,3,5-triazin-2-yl)benzo[g][1,3]benzoxazole
CID 138633567
2-[3-[6-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]phenyl]-1,3-benzoxazole
CID 155357091
4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)-2-[3-(4-phenylphenyl)phenyl]quinazoline;4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)-2-(4-phenylphenyl)quinazoline;4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)-2-phenylquinazoline
CID 158481385
2-dibenzofuran-3-yl-4-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]-6-phenyl-1,3,5-triazine
CID 154626584
2-[4-[6-[3-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]dibenzothiophen-2-yl]phenyl]-1,3-benzoxazole
CID 155356881

Frequently Asked Questions

What is the IUPAC name of 7-(3-dibenzofuran-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;7-(3-dibenzothiophen-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;8-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylbenzo[e][1,3]benzothiazole;2-phenyl-7-[3-(4-phenylquinazolin-2-yl)phenyl]benzo[g][1,3]benzoxazole;2-phenyl-7-[3-(3-phenylquinoxalin-2-yl)phenyl]benzo[g][1,3]benzoxazole?
The IUPAC name of 7-(3-dibenzofuran-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;7-(3-dibenzothiophen-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;8-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylbenzo[e][1,3]benzothiazole;2-phenyl-7-[3-(4-phenylquinazolin-2-yl)phenyl]benzo[g][1,3]benzoxazole;2-phenyl-7-[3-(3-phenylquinoxalin-2-yl)phenyl]benzo[g][1,3]benzoxazole (CID 160756920) is 7-(3-dibenzofuran-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;7-(3-dibenzothiophen-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;8-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylbenzo[e][1,3]benzothiazole;2-phenyl-7-[3-(4-phenylquinazolin-2-yl)phenyl]benzo[g][1,3]benzoxazole;2-phenyl-7-[3-(3-phenylquinoxalin-2-yl)phenyl]benzo[g][1,3]benzoxazole.
What is the SMILES notation for 7-(3-dibenzofuran-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;7-(3-dibenzothiophen-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;8-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylbenzo[e][1,3]benzothiazole;2-phenyl-7-[3-(4-phenylquinazolin-2-yl)phenyl]benzo[g][1,3]benzoxazole;2-phenyl-7-[3-(3-phenylquinoxalin-2-yl)phenyl]benzo[g][1,3]benzoxazole?
The canonical SMILES for 7-(3-dibenzofuran-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;7-(3-dibenzothiophen-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;8-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylbenzo[e][1,3]benzothiazole;2-phenyl-7-[3-(4-phenylquinazolin-2-yl)phenyl]benzo[g][1,3]benzoxazole;2-phenyl-7-[3-(3-phenylquinoxalin-2-yl)phenyl]benzo[g][1,3]benzoxazole is c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4ccc5sc(-c6ccccc6)nc5c4c3)n2)cc1.c1ccc(-c2nc3ccc4cc(-c5cccc(-c6cccc7c6oc6ccccc67)c5)ccc4c3o2)cc1.c1ccc(-c2nc3ccc4cc(-c5cccc(-c6cccc7c6sc6ccccc67)c5)ccc4c3o2)cc1.c1ccc(-c2nc3ccc4cc(-c5cccc(-c6nc(-c7ccccc7)c7ccccc7n6)c5)ccc4c3o2)cc1.c1ccc(-c2nc3ccc4cc(-c5cccc(-c6nc7ccccc7nc6-c6ccccc6)c5)ccc4c3o2)cc1.
What is the InChIKey of 7-(3-dibenzofuran-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;7-(3-dibenzothiophen-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;8-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylbenzo[e][1,3]benzothiazole;2-phenyl-7-[3-(4-phenylquinazolin-2-yl)phenyl]benzo[g][1,3]benzoxazole;2-phenyl-7-[3-(3-phenylquinoxalin-2-yl)phenyl]benzo[g][1,3]benzoxazole?
The InChIKey is RXOBNEXDZUQJJK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C37H23N3O.C35H21NO2.C35H21NOS.C32H20N4S/c1-3-10-24(11-4-1)34-35(39-32-17-8-7-16-31(32)38-34)29-15-9-14-26(23-29)27-18-20-30-28(22-27)19-21-33-36(30)41-37(40-33)25-12-5-2-6-13-25;1-3-10-24(11-4-1)34-31-16-7-8-17-32(31)38-36(40-34)29-15-9-14-26(23-29)27-18-20-30-28(22-27)19-21-33-35(30)41-37(39-33)25-12-5-2-6-13-25;1-2-8-22(9-3-1)35-36-31-19-17-26-21-24(16-18-28(26)34(31)38-35)23-10-6-11-25(20-23)27-13-7-14-30-29-12-4-5-15-32(29)37-33(27)30;1-2-8-22(9-3-1)35-36-31-19-17-26-21-24(16-18-27(26)33(31)37-35)23-10-6-11-25(20-23)28-13-7-14-30-29-12-4-5-15-32(29)38-34(28)30;1-4-10-22(11-5-1)29-34-30(23-12-6-2-7-13-23)36-31(35-29)25-17-16-21-18-19-27-28(26(21)20-25)33-32(37-27)24-14-8-3-9-15-24/h2*1-23H;2*1-21H;1-20H.
What are the key properties of 7-(3-dibenzofuran-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;7-(3-dibenzothiophen-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;8-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylbenzo[e][1,3]benzothiazole;2-phenyl-7-[3-(4-phenylquinazolin-2-yl)phenyl]benzo[g][1,3]benzoxazole;2-phenyl-7-[3-(3-phenylquinoxalin-2-yl)phenyl]benzo[g][1,3]benzoxazole?
7-(3-dibenzofuran-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;7-(3-dibenzothiophen-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;8-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylbenzo[e][1,3]benzothiazole;2-phenyl-7-[3-(4-phenylquinazolin-2-yl)phenyl]benzo[g][1,3]benzoxazole;2-phenyl-7-[3-(3-phenylquinoxalin-2-yl)phenyl]benzo[g][1,3]benzoxazole has a molecular weight of 2535.01 g/mol, XLogP of 47.72, 18 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3-dibenzofuran-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;7-(3-dibenzothiophen-4-ylphenyl)-2-phenylbenzo[g][1,3]benzoxazole;8-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylbenzo[e][1,3]benzothiazole;2-phenyl-7-[3-(4-phenylquinazolin-2-yl)phenyl]benzo[g][1,3]benzoxazole;2-phenyl-7-[3-(3-phenylquinoxalin-2-yl)phenyl]benzo[g][1,3]benzoxazole is sourced from PubChem (CID 160756920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).