2-[3-(2,8-dimethyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-diphenyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;1-phenyl-2-[3-(6-phenyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-trimethyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-triphenyldibenzothiophen-4-yl)phenyl]benzimidazole

C196H134N10S5 — CID 157476089

IUPAC2-[3-(2,8-dimethyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-diphenyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;1-phenyl-2-[3-(6-phenyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-trimethyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-triphenyldibenzothiophen-4-yl)phenyl]benzimidazole
SMILESCc1cc(C)c2sc3c(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cc(C)cc3c2c1.Cc1ccc2sc3c(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cc(C)cc3c2c1.c1ccc(-c2cc(-c3ccccc3)c3sc4c(-c5cccc(-c6nc7ccccc7n6-c6ccccc6)c5)cc(-c5ccccc5)cc4c3c2)cc1.c1ccc(-c2ccc3sc4c(-c5cccc(-c6nc7ccccc7n6-c6ccccc6)c5)cc(-c5ccccc5)cc4c3c2)cc1.c1ccc(-c2cccc3c2sc2c(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cccc23)cc1
InChIInChI=1S/C49H32N2S.C43H28N2S.C37H24N2S.C34H26N2S.C33H24N2S/c1-5-16-33(17-6-1)38-29-41(35-20-9-3-10-21-35)47-43(31-38)44-32-39(34-18-7-2-8-19-34)30-42(48(44)52-47)36-22-15-23-37(28-36)49-50-45-26-13-14-27-46(45)51(49)40-24-11-4-12-25-40;1-4-13-29(14-5-1)31-23-24-41-37(26-31)38-28-34(30-15-6-2-7-16-30)27-36(42(38)46-41)32-17-12-18-33(25-32)43-44-39-21-10-11-22-40(39)45(43)35-19-8-3-9-20-35;1-3-12-25(13-4-1)29-18-10-20-31-32-21-11-19-30(36(32)40-35(29)31)26-14-9-15-27(24-26)37-38-33-22-7-8-23-34(33)39(37)28-16-5-2-6-17-28;1-21-16-23(3)32-28(18-21)29-19-22(2)17-27(33(29)37-32)24-10-9-11-25(20-24)34-35-30-14-7-8-15-31(30)36(34)26-12-5-4-6-13-26;1-21-15-16-31-27(17-21)28-19-22(2)18-26(32(28)36-31)23-9-8-10-24(20-23)33-34-29-13-6-7-14-30(29)35(33)25-11-4-3-5-12-25/h1-32H;1-28H;1-24H;4-20H,1-3H3;3-20H,1-2H3
InChIKeyBVPLDDFXLYNCCF-UHFFFAOYSA-N
MW2789.63 g/mol
LogP55.18
Rot. Bonds21

About 2-[3-(2,8-dimethyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-diphenyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;1-phenyl-2-[3-(6-phenyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-trimethyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-triphenyldibenzothiophen-4-yl)phenyl]benzimidazole

2-[3-(2,8-dimethyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-diphenyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;1-phenyl-2-[3-(6-phenyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-trimethyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-triphenyldibenzothiophen-4-yl)phenyl]benzimidazole (PubChem CID 157476089) has the molecular formula C196H134N10S5 and a molecular weight of 2789.63 g/mol. Its IUPAC name is 2-[3-(2,8-dimethyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-diphenyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;1-phenyl-2-[3-(6-phenyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-trimethyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-triphenyldibenzothiophen-4-yl)phenyl]benzimidazole.

Molecular Properties

Compound Name2-[3-(2,8-dimethyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-diphenyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;1-phenyl-2-[3-(6-phenyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-trimethyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-triphenyldibenzothiophen-4-yl)phenyl]benzimidazole
PubChem CID157476089
Molecular FormulaC196H134N10S5
Molecular Weight2789.63 g/mol
Exact Mass2786.94
IUPAC Name2-[3-(2,8-dimethyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-diphenyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;1-phenyl-2-[3-(6-phenyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-trimethyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-triphenyldibenzothiophen-4-yl)phenyl]benzimidazole
SMILESCc1cc(C)c2sc3c(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cc(C)cc3c2c1.Cc1ccc2sc3c(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cc(C)cc3c2c1.c1ccc(-c2cc(-c3ccccc3)c3sc4c(-c5cccc(-c6nc7ccccc7n6-c6ccccc6)c5)cc(-c5ccccc5)cc4c3c2)cc1.c1ccc(-c2ccc3sc4c(-c5cccc(-c6nc7ccccc7n6-c6ccccc6)c5)cc(-c5ccccc5)cc4c3c2)cc1.c1ccc(-c2cccc3c2sc2c(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cccc23)cc1
InChIInChI=1S/C49H32N2S.C43H28N2S.C37H24N2S.C34H26N2S.C33H24N2S/c1-5-16-33(17-6-1)38-29-41(35-20-9-3-10-21-35)47-43(31-38)44-32-39(34-18-7-2-8-19-34)30-42(48(44)52-47)36-22-15-23-37(28-36)49-50-45-26-13-14-27-46(45)51(49)40-24-11-4-12-25-40;1-4-13-29(14-5-1)31-23-24-41-37(26-31)38-28-34(30-15-6-2-7-16-30)27-36(42(38)46-41)32-17-12-18-33(25-32)43-44-39-21-10-11-22-40(39)45(43)35-19-8-3-9-20-35;1-3-12-25(13-4-1)29-18-10-20-31-32-21-11-19-30(36(32)40-35(29)31)26-14-9-15-27(24-26)37-38-33-22-7-8-23-34(33)39(37)28-16-5-2-6-17-28;1-21-16-23(3)32-28(18-21)29-19-22(2)17-27(33(29)37-32)24-10-9-11-25(20-24)34-35-30-14-7-8-15-31(30)36(34)26-12-5-4-6-13-26;1-21-15-16-31-27(17-21)28-19-22(2)18-26(32(28)36-31)23-9-8-10-24(20-23)33-34-29-13-6-7-14-30(29)35(33)25-11-4-3-5-12-25/h1-32H;1-28H;1-24H;4-20H,1-3H3;3-20H,1-2H3
InChIKeyBVPLDDFXLYNCCF-UHFFFAOYSA-N
XLogP55.18
TPSA89.10 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds21
Heavy Atoms211
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002789.63
LogP ≤ 555.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 2-[3-(2,8-dimethyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-diphenyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;1-phenyl-2-[3-(6-phenyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-trimethyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-triphenyldibenzothiophen-4-yl)phenyl]benzimidazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(2,8-dimethyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-diphenyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;1-phenyl-2-[3-(6-phenyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-trimethyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-triphenyldibenzothiophen-4-yl)phenyl]benzimidazole?
The IUPAC name of 2-[3-(2,8-dimethyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-diphenyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;1-phenyl-2-[3-(6-phenyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-trimethyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-triphenyldibenzothiophen-4-yl)phenyl]benzimidazole (CID 157476089) is 2-[3-(2,8-dimethyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-diphenyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;1-phenyl-2-[3-(6-phenyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-trimethyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-triphenyldibenzothiophen-4-yl)phenyl]benzimidazole.
What is the SMILES notation for 2-[3-(2,8-dimethyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-diphenyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;1-phenyl-2-[3-(6-phenyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-trimethyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-triphenyldibenzothiophen-4-yl)phenyl]benzimidazole?
The canonical SMILES for 2-[3-(2,8-dimethyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-diphenyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;1-phenyl-2-[3-(6-phenyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-trimethyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-triphenyldibenzothiophen-4-yl)phenyl]benzimidazole is Cc1cc(C)c2sc3c(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cc(C)cc3c2c1.Cc1ccc2sc3c(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cc(C)cc3c2c1.c1ccc(-c2cc(-c3ccccc3)c3sc4c(-c5cccc(-c6nc7ccccc7n6-c6ccccc6)c5)cc(-c5ccccc5)cc4c3c2)cc1.c1ccc(-c2ccc3sc4c(-c5cccc(-c6nc7ccccc7n6-c6ccccc6)c5)cc(-c5ccccc5)cc4c3c2)cc1.c1ccc(-c2cccc3c2sc2c(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cccc23)cc1.
What is the InChIKey of 2-[3-(2,8-dimethyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-diphenyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;1-phenyl-2-[3-(6-phenyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-trimethyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-triphenyldibenzothiophen-4-yl)phenyl]benzimidazole?
The InChIKey is BVPLDDFXLYNCCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H32N2S.C43H28N2S.C37H24N2S.C34H26N2S.C33H24N2S/c1-5-16-33(17-6-1)38-29-41(35-20-9-3-10-21-35)47-43(31-38)44-32-39(34-18-7-2-8-19-34)30-42(48(44)52-47)36-22-15-23-37(28-36)49-50-45-26-13-14-27-46(45)51(49)40-24-11-4-12-25-40;1-4-13-29(14-5-1)31-23-24-41-37(26-31)38-28-34(30-15-6-2-7-16-30)27-36(42(38)46-41)32-17-12-18-33(25-32)43-44-39-21-10-11-22-40(39)45(43)35-19-8-3-9-20-35;1-3-12-25(13-4-1)29-18-10-20-31-32-21-11-19-30(36(32)40-35(29)31)26-14-9-15-27(24-26)37-38-33-22-7-8-23-34(33)39(37)28-16-5-2-6-17-28;1-21-16-23(3)32-28(18-21)29-19-22(2)17-27(33(29)37-32)24-10-9-11-25(20-24)34-35-30-14-7-8-15-31(30)36(34)26-12-5-4-6-13-26;1-21-15-16-31-27(17-21)28-19-22(2)18-26(32(28)36-31)23-9-8-10-24(20-23)33-34-29-13-6-7-14-30(29)35(33)25-11-4-3-5-12-25/h1-32H;1-28H;1-24H;4-20H,1-3H3;3-20H,1-2H3.
What are the key properties of 2-[3-(2,8-dimethyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-diphenyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;1-phenyl-2-[3-(6-phenyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-trimethyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-triphenyldibenzothiophen-4-yl)phenyl]benzimidazole?
2-[3-(2,8-dimethyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-diphenyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;1-phenyl-2-[3-(6-phenyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-trimethyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-triphenyldibenzothiophen-4-yl)phenyl]benzimidazole has a molecular weight of 2789.63 g/mol, XLogP of 55.18, 21 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2,8-dimethyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-diphenyldibenzothiophen-4-yl)phenyl]-1-phenylbenzimidazole;1-phenyl-2-[3-(6-phenyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-trimethyldibenzothiophen-4-yl)phenyl]benzimidazole;1-phenyl-2-[3-(2,6,8-triphenyldibenzothiophen-4-yl)phenyl]benzimidazole is sourced from PubChem (CID 157476089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).