2-dibenzofuran-4-yl-5-methylbenzimidazolo[1,2-a]benzimidazole;2-methyldibenzofuran;4-methyldibenzofuran;5-(8-methyldibenzofuran-2-yl)benzimidazolo[1,2-a]benzimidazole;5-(3-methylphenyl)benzimidazolo[1,2-a]benzimidazole;9-(3-methylphenyl)carbazole

C117H84N10O4 — CID 157476739

IUPAC2-dibenzofuran-4-yl-5-methylbenzimidazolo[1,2-a]benzimidazole;2-methyldibenzofuran;4-methyldibenzofuran;5-(8-methyldibenzofuran-2-yl)benzimidazolo[1,2-a]benzimidazole;5-(3-methylphenyl)benzimidazolo[1,2-a]benzimidazole;9-(3-methylphenyl)carbazole
SMILESCc1ccc2oc3ccc(-n4c5ccccc5n5c6ccccc6nc45)cc3c2c1.Cc1ccc2oc3ccccc3c2c1.Cc1cccc(-n2c3ccccc3c3ccccc32)c1.Cc1cccc(-n2c3ccccc3n3c4ccccc4nc23)c1.Cc1cccc2c1oc1ccccc12.Cn1c2ccc(-c3cccc4c3oc3ccccc34)cc2n2c3ccccc3nc12
InChIInChI=1S/2C26H17N3O.C20H15N3.C19H15N.2C13H10O/c1-28-22-14-13-16(15-23(22)29-21-11-4-3-10-20(21)27-26(28)29)17-8-6-9-19-18-7-2-5-12-24(18)30-25(17)19;1-16-10-12-24-18(14-16)19-15-17(11-13-25(19)30-24)28-22-8-4-5-9-23(22)29-21-7-3-2-6-20(21)27-26(28)29;1-14-7-6-8-15(13-14)22-18-11-4-5-12-19(18)23-17-10-3-2-9-16(17)21-20(22)23;1-14-7-6-8-15(13-14)20-18-11-4-2-9-16(18)17-10-3-5-12-19(17)20;1-9-5-4-7-11-10-6-2-3-8-12(10)14-13(9)11;1-9-6-7-13-11(8-9)10-4-2-3-5-12(10)14-13/h2*2-15H,1H3;2-13H,1H3;2-13H,1H3;2*2-8H,1H3
InChIKeyBVRIKRJTBACTDX-UHFFFAOYSA-N
MW1694.02 g/mol
LogP30.81
Rot. Bonds4

About 2-dibenzofuran-4-yl-5-methylbenzimidazolo[1,2-a]benzimidazole;2-methyldibenzofuran;4-methyldibenzofuran;5-(8-methyldibenzofuran-2-yl)benzimidazolo[1,2-a]benzimidazole;5-(3-methylphenyl)benzimidazolo[1,2-a]benzimidazole;9-(3-methylphenyl)carbazole

2-dibenzofuran-4-yl-5-methylbenzimidazolo[1,2-a]benzimidazole;2-methyldibenzofuran;4-methyldibenzofuran;5-(8-methyldibenzofuran-2-yl)benzimidazolo[1,2-a]benzimidazole;5-(3-methylphenyl)benzimidazolo[1,2-a]benzimidazole;9-(3-methylphenyl)carbazole (PubChem CID 157476739) has the molecular formula C117H84N10O4 and a molecular weight of 1694.02 g/mol. Its IUPAC name is 2-dibenzofuran-4-yl-5-methylbenzimidazolo[1,2-a]benzimidazole;2-methyldibenzofuran;4-methyldibenzofuran;5-(8-methyldibenzofuran-2-yl)benzimidazolo[1,2-a]benzimidazole;5-(3-methylphenyl)benzimidazolo[1,2-a]benzimidazole;9-(3-methylphenyl)carbazole.

Molecular Properties

Compound Name2-dibenzofuran-4-yl-5-methylbenzimidazolo[1,2-a]benzimidazole;2-methyldibenzofuran;4-methyldibenzofuran;5-(8-methyldibenzofuran-2-yl)benzimidazolo[1,2-a]benzimidazole;5-(3-methylphenyl)benzimidazolo[1,2-a]benzimidazole;9-(3-methylphenyl)carbazole
PubChem CID157476739
Molecular FormulaC117H84N10O4
Molecular Weight1694.02 g/mol
Exact Mass1692.67
IUPAC Name2-dibenzofuran-4-yl-5-methylbenzimidazolo[1,2-a]benzimidazole;2-methyldibenzofuran;4-methyldibenzofuran;5-(8-methyldibenzofuran-2-yl)benzimidazolo[1,2-a]benzimidazole;5-(3-methylphenyl)benzimidazolo[1,2-a]benzimidazole;9-(3-methylphenyl)carbazole
SMILESCc1ccc2oc3ccc(-n4c5ccccc5n5c6ccccc6nc45)cc3c2c1.Cc1ccc2oc3ccccc3c2c1.Cc1cccc(-n2c3ccccc3c3ccccc32)c1.Cc1cccc(-n2c3ccccc3n3c4ccccc4nc23)c1.Cc1cccc2c1oc1ccccc12.Cn1c2ccc(-c3cccc4c3oc3ccccc34)cc2n2c3ccccc3nc12
InChIInChI=1S/2C26H17N3O.C20H15N3.C19H15N.2C13H10O/c1-28-22-14-13-16(15-23(22)29-21-11-4-3-10-20(21)27-26(28)29)17-8-6-9-19-18-7-2-5-12-24(18)30-25(17)19;1-16-10-12-24-18(14-16)19-15-17(11-13-25(19)30-24)28-22-8-4-5-9-23(22)29-21-7-3-2-6-20(21)27-26(28)29;1-14-7-6-8-15(13-14)22-18-11-4-5-12-19(18)23-17-10-3-2-9-16(17)21-20(22)23;1-14-7-6-8-15(13-14)20-18-11-4-2-9-16(18)17-10-3-5-12-19(17)20;1-9-5-4-7-11-10-6-2-3-8-12(10)14-13(9)11;1-9-6-7-13-11(8-9)10-4-2-3-5-12(10)14-13/h2*2-15H,1H3;2-13H,1H3;2-13H,1H3;2*2-8H,1H3
InChIKeyBVRIKRJTBACTDX-UHFFFAOYSA-N
XLogP30.81
TPSA124.18 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds4
Heavy Atoms131
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001694.02
LogP ≤ 530.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Analyze 2-dibenzofuran-4-yl-5-methylbenzimidazolo[1,2-a]benzimidazole;2-methyldibenzofuran;4-methyldibenzofuran;5-(8-methyldibenzofuran-2-yl)benzimidazolo[1,2-a]benzimidazole;5-(3-methylphenyl)benzimidazolo[1,2-a]benzimidazole;9-(3-methylphenyl)carbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-methylbenzimidazolo[1,2-a]benzimidazole;bis(9-methylcarbazole);2-methyldibenzofuran;3-methyldibenzofuran;4-methyldibenzofuran;toluene
CID 162116737
3-carbazol-9-yl-5-(8-methyldibenzofuran-2-yl)benzimidazolo[1,2-a]benzimidazole
CID 118243470
5-(4-methyldibenzofuran-2-yl)benzimidazolo[1,2-a]benzimidazole;5-(6-methyldibenzofuran-2-yl)benzimidazolo[1,2-a]benzimidazole;5-(8-methyldibenzofuran-4-yl)benzimidazolo[1,2-a]benzimidazole;9-(2-methyldibenzofuran-4-yl)carbazole;9-(4-methyldibenzofuran-2-yl)carbazole;9-(8-methyldibenzofuran-4-yl)carbazole
CID 161427199
2-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-6-phenylbenzimidazolo[1,2-a]benzimidazole
CID 140923360
2-carbazol-9-yl-6-(8-methyldibenzofuran-2-yl)benzimidazolo[1,2-a]benzimidazole;3-carbazol-9-yl-9-(8-methyldibenzofuran-2-yl)carbazole;5-(8-methyldibenzofuran-1-yl)benzimidazolo[1,2-a]benzimidazole;9-(8-methyldibenzofuran-1-yl)carbazole;9-(8-methyldibenzofuran-2-yl)carbazole
CID 157203937
17-[8-(3-carbazol-9-ylphenyl)dibenzofuran-2-yl]-1,8,15,17,19-pentazahexacyclo[16.7.0.02,7.08,16.09,14.020,25]pentacosa-2,4,6,9,11,13,15,18,20,22,24-undecaene;4-(9-dibenzofuran-2-ylcarbazol-3-yl)-17-phenyl-1,8,15,17,19-pentazahexacyclo[16.7.0.02,7.08,16.09,14.020,25]pentacosa-2(7),3,5,9,11,13,15,18,20,22,24-undecaene;17-dibenzofuran-2-yl-4-(9-phenylcarbazol-3-yl)-1,8,15,17,19-pentazahexacyclo[16.7.0.02,7.08,16.09,14.020,25]pentacosa-2(7),3,5,9,11,13,15,18,20,22,24-undecaene
CID 158372183
5-[8-[6-(3-carbazol-9-ylcarbazol-9-yl)dibenzofuran-2-yl]dibenzofuran-1-yl]benzimidazolo[1,2-a]benzimidazole;5-[8-[8-(3-carbazol-9-ylcarbazol-9-yl)dibenzofuran-2-yl]dibenzofuran-1-yl]benzimidazolo[1,2-a]benzimidazole;5-[8-[9-(3-carbazol-9-ylcarbazol-9-yl)dibenzofuran-2-yl]dibenzofuran-1-yl]benzimidazolo[1,2-a]benzimidazole
CID 159498435
5-[6-(9-phenylcarbazol-3-yl)dibenzofuran-1-yl]benzimidazolo[1,2-a]benzimidazole
CID 121420272
9-[4-[1-(4-tert-butylphenyl)benzimidazol-2-yl]phenyl]-3-dibenzofuran-4-ylcarbazole;3-dibenzofuran-4-yl-9-[4-[1-(2-methylphenyl)benzimidazol-2-yl]phenyl]carbazole;3-dibenzofuran-4-yl-9-[4-[1-(3-methylphenyl)benzimidazol-2-yl]phenyl]carbazole;3-dibenzofuran-4-yl-9-[4-[1-(4-methylphenyl)benzimidazol-2-yl]phenyl]carbazole
CID 161304554
4-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-6-phenylbenzimidazolo[1,2-a]benzimidazole
CID 140923359
9-[3-(8-carbazol-9-yldibenzofuran-4-yl)phenyl]-3-dibenzofuran-4-ylcarbazole
CID 58099745
9-(4-dibenzofuran-4-ylphenyl)-3-methylcarbazole
CID 129128081

Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-4-yl-5-methylbenzimidazolo[1,2-a]benzimidazole;2-methyldibenzofuran;4-methyldibenzofuran;5-(8-methyldibenzofuran-2-yl)benzimidazolo[1,2-a]benzimidazole;5-(3-methylphenyl)benzimidazolo[1,2-a]benzimidazole;9-(3-methylphenyl)carbazole?
The IUPAC name of 2-dibenzofuran-4-yl-5-methylbenzimidazolo[1,2-a]benzimidazole;2-methyldibenzofuran;4-methyldibenzofuran;5-(8-methyldibenzofuran-2-yl)benzimidazolo[1,2-a]benzimidazole;5-(3-methylphenyl)benzimidazolo[1,2-a]benzimidazole;9-(3-methylphenyl)carbazole (CID 157476739) is 2-dibenzofuran-4-yl-5-methylbenzimidazolo[1,2-a]benzimidazole;2-methyldibenzofuran;4-methyldibenzofuran;5-(8-methyldibenzofuran-2-yl)benzimidazolo[1,2-a]benzimidazole;5-(3-methylphenyl)benzimidazolo[1,2-a]benzimidazole;9-(3-methylphenyl)carbazole.
What is the SMILES notation for 2-dibenzofuran-4-yl-5-methylbenzimidazolo[1,2-a]benzimidazole;2-methyldibenzofuran;4-methyldibenzofuran;5-(8-methyldibenzofuran-2-yl)benzimidazolo[1,2-a]benzimidazole;5-(3-methylphenyl)benzimidazolo[1,2-a]benzimidazole;9-(3-methylphenyl)carbazole?
The canonical SMILES for 2-dibenzofuran-4-yl-5-methylbenzimidazolo[1,2-a]benzimidazole;2-methyldibenzofuran;4-methyldibenzofuran;5-(8-methyldibenzofuran-2-yl)benzimidazolo[1,2-a]benzimidazole;5-(3-methylphenyl)benzimidazolo[1,2-a]benzimidazole;9-(3-methylphenyl)carbazole is Cc1ccc2oc3ccc(-n4c5ccccc5n5c6ccccc6nc45)cc3c2c1.Cc1ccc2oc3ccccc3c2c1.Cc1cccc(-n2c3ccccc3c3ccccc32)c1.Cc1cccc(-n2c3ccccc3n3c4ccccc4nc23)c1.Cc1cccc2c1oc1ccccc12.Cn1c2ccc(-c3cccc4c3oc3ccccc34)cc2n2c3ccccc3nc12.
What is the InChIKey of 2-dibenzofuran-4-yl-5-methylbenzimidazolo[1,2-a]benzimidazole;2-methyldibenzofuran;4-methyldibenzofuran;5-(8-methyldibenzofuran-2-yl)benzimidazolo[1,2-a]benzimidazole;5-(3-methylphenyl)benzimidazolo[1,2-a]benzimidazole;9-(3-methylphenyl)carbazole?
The InChIKey is BVRIKRJTBACTDX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C26H17N3O.C20H15N3.C19H15N.2C13H10O/c1-28-22-14-13-16(15-23(22)29-21-11-4-3-10-20(21)27-26(28)29)17-8-6-9-19-18-7-2-5-12-24(18)30-25(17)19;1-16-10-12-24-18(14-16)19-15-17(11-13-25(19)30-24)28-22-8-4-5-9-23(22)29-21-7-3-2-6-20(21)27-26(28)29;1-14-7-6-8-15(13-14)22-18-11-4-5-12-19(18)23-17-10-3-2-9-16(17)21-20(22)23;1-14-7-6-8-15(13-14)20-18-11-4-2-9-16(18)17-10-3-5-12-19(17)20;1-9-5-4-7-11-10-6-2-3-8-12(10)14-13(9)11;1-9-6-7-13-11(8-9)10-4-2-3-5-12(10)14-13/h2*2-15H,1H3;2-13H,1H3;2-13H,1H3;2*2-8H,1H3.
What are the key properties of 2-dibenzofuran-4-yl-5-methylbenzimidazolo[1,2-a]benzimidazole;2-methyldibenzofuran;4-methyldibenzofuran;5-(8-methyldibenzofuran-2-yl)benzimidazolo[1,2-a]benzimidazole;5-(3-methylphenyl)benzimidazolo[1,2-a]benzimidazole;9-(3-methylphenyl)carbazole?
2-dibenzofuran-4-yl-5-methylbenzimidazolo[1,2-a]benzimidazole;2-methyldibenzofuran;4-methyldibenzofuran;5-(8-methyldibenzofuran-2-yl)benzimidazolo[1,2-a]benzimidazole;5-(3-methylphenyl)benzimidazolo[1,2-a]benzimidazole;9-(3-methylphenyl)carbazole has a molecular weight of 1694.02 g/mol, XLogP of 30.81, 4 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzofuran-4-yl-5-methylbenzimidazolo[1,2-a]benzimidazole;2-methyldibenzofuran;4-methyldibenzofuran;5-(8-methyldibenzofuran-2-yl)benzimidazolo[1,2-a]benzimidazole;5-(3-methylphenyl)benzimidazolo[1,2-a]benzimidazole;9-(3-methylphenyl)carbazole is sourced from PubChem (CID 157476739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).