2-dibenzofuran-4-yl-6-methyl-4-phenylpyridine;4-(3-dibenzofuran-4-yl-5-methylphenyl)pyridine;4-(3-dibenzothiophen-4-yl-5-methylphenyl)pyridine;9-(6-methyl-4-phenyl-2-pyridinyl)carbazole;9-(3-methyl-5-pyridin-4-ylphenyl)carbazole

C120H87N7O2S — CID 157443051

IUPAC2-dibenzofuran-4-yl-6-methyl-4-phenylpyridine;4-(3-dibenzofuran-4-yl-5-methylphenyl)pyridine;4-(3-dibenzothiophen-4-yl-5-methylphenyl)pyridine;9-(6-methyl-4-phenyl-2-pyridinyl)carbazole;9-(3-methyl-5-pyridin-4-ylphenyl)carbazole
SMILESCc1cc(-c2ccccc2)cc(-c2cccc3c2oc2ccccc23)n1.Cc1cc(-c2ccccc2)cc(-n2c3ccccc3c3ccccc32)n1.Cc1cc(-c2ccncc2)cc(-c2cccc3c2oc2ccccc23)c1.Cc1cc(-c2ccncc2)cc(-c2cccc3c2sc2ccccc23)c1.Cc1cc(-c2ccncc2)cc(-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/2C24H18N2.2C24H17NO.C24H17NS/c1-17-14-19(18-10-12-25-13-11-18)16-20(15-17)26-23-8-4-2-6-21(23)22-7-3-5-9-24(22)26;1-17-15-19(18-9-3-2-4-10-18)16-24(25-17)26-22-13-7-5-11-20(22)21-12-6-8-14-23(21)26;1-16-13-18(17-9-11-25-12-10-17)15-19(14-16)20-6-4-7-22-21-5-2-3-8-23(21)26-24(20)22;1-16-14-18(17-8-3-2-4-9-17)15-22(25-16)21-12-7-11-20-19-10-5-6-13-23(19)26-24(20)21;1-16-13-18(17-9-11-25-12-10-17)15-19(14-16)20-6-4-7-22-21-5-2-3-8-23(21)26-24(20)22/h2*2-16H,1H3;3*2-15H,1H3
InChIKeyBRWZDLVYFZFGJW-UHFFFAOYSA-N
MW1691.13 g/mol
LogP32.65
Rot. Bonds10

About 2-dibenzofuran-4-yl-6-methyl-4-phenylpyridine;4-(3-dibenzofuran-4-yl-5-methylphenyl)pyridine;4-(3-dibenzothiophen-4-yl-5-methylphenyl)pyridine;9-(6-methyl-4-phenyl-2-pyridinyl)carbazole;9-(3-methyl-5-pyridin-4-ylphenyl)carbazole

2-dibenzofuran-4-yl-6-methyl-4-phenylpyridine;4-(3-dibenzofuran-4-yl-5-methylphenyl)pyridine;4-(3-dibenzothiophen-4-yl-5-methylphenyl)pyridine;9-(6-methyl-4-phenyl-2-pyridinyl)carbazole;9-(3-methyl-5-pyridin-4-ylphenyl)carbazole (PubChem CID 157443051) has the molecular formula C120H87N7O2S and a molecular weight of 1691.13 g/mol. Its IUPAC name is 2-dibenzofuran-4-yl-6-methyl-4-phenylpyridine;4-(3-dibenzofuran-4-yl-5-methylphenyl)pyridine;4-(3-dibenzothiophen-4-yl-5-methylphenyl)pyridine;9-(6-methyl-4-phenyl-2-pyridinyl)carbazole;9-(3-methyl-5-pyridin-4-ylphenyl)carbazole.

Molecular Properties

Compound Name2-dibenzofuran-4-yl-6-methyl-4-phenylpyridine;4-(3-dibenzofuran-4-yl-5-methylphenyl)pyridine;4-(3-dibenzothiophen-4-yl-5-methylphenyl)pyridine;9-(6-methyl-4-phenyl-2-pyridinyl)carbazole;9-(3-methyl-5-pyridin-4-ylphenyl)carbazole
PubChem CID157443051
Molecular FormulaC120H87N7O2S
Molecular Weight1691.13 g/mol
Exact Mass1689.66
IUPAC Name2-dibenzofuran-4-yl-6-methyl-4-phenylpyridine;4-(3-dibenzofuran-4-yl-5-methylphenyl)pyridine;4-(3-dibenzothiophen-4-yl-5-methylphenyl)pyridine;9-(6-methyl-4-phenyl-2-pyridinyl)carbazole;9-(3-methyl-5-pyridin-4-ylphenyl)carbazole
SMILESCc1cc(-c2ccccc2)cc(-c2cccc3c2oc2ccccc23)n1.Cc1cc(-c2ccccc2)cc(-n2c3ccccc3c3ccccc32)n1.Cc1cc(-c2ccncc2)cc(-c2cccc3c2oc2ccccc23)c1.Cc1cc(-c2ccncc2)cc(-c2cccc3c2sc2ccccc23)c1.Cc1cc(-c2ccncc2)cc(-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/2C24H18N2.2C24H17NO.C24H17NS/c1-17-14-19(18-10-12-25-13-11-18)16-20(15-17)26-23-8-4-2-6-21(23)22-7-3-5-9-24(22)26;1-17-15-19(18-9-3-2-4-10-18)16-24(25-17)26-22-13-7-5-11-20(22)21-12-6-8-14-23(21)26;1-16-13-18(17-9-11-25-12-10-17)15-19(14-16)20-6-4-7-22-21-5-2-3-8-23(21)26-24(20)22;1-16-14-18(17-8-3-2-4-9-17)15-22(25-16)21-12-7-11-20-19-10-5-6-13-23(19)26-24(20)21;1-16-13-18(17-9-11-25-12-10-17)15-19(14-16)20-6-4-7-22-21-5-2-3-8-23(21)26-24(20)22/h2*2-16H,1H3;3*2-15H,1H3
InChIKeyBRWZDLVYFZFGJW-UHFFFAOYSA-N
XLogP32.65
TPSA100.59 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds10
Heavy Atoms130
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001691.13
LogP ≤ 532.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 2-dibenzofuran-4-yl-6-methyl-4-phenylpyridine;4-(3-dibenzofuran-4-yl-5-methylphenyl)pyridine;4-(3-dibenzothiophen-4-yl-5-methylphenyl)pyridine;9-(6-methyl-4-phenyl-2-pyridinyl)carbazole;9-(3-methyl-5-pyridin-4-ylphenyl)carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-4-yl-6-methyl-4-phenylpyridine;4-(3-dibenzofuran-4-yl-5-methylphenyl)pyridine;4-(3-dibenzothiophen-4-yl-5-methylphenyl)pyridine;9-(6-methyl-4-phenyl-2-pyridinyl)carbazole;9-(3-methyl-5-pyridin-4-ylphenyl)carbazole?
The IUPAC name of 2-dibenzofuran-4-yl-6-methyl-4-phenylpyridine;4-(3-dibenzofuran-4-yl-5-methylphenyl)pyridine;4-(3-dibenzothiophen-4-yl-5-methylphenyl)pyridine;9-(6-methyl-4-phenyl-2-pyridinyl)carbazole;9-(3-methyl-5-pyridin-4-ylphenyl)carbazole (CID 157443051) is 2-dibenzofuran-4-yl-6-methyl-4-phenylpyridine;4-(3-dibenzofuran-4-yl-5-methylphenyl)pyridine;4-(3-dibenzothiophen-4-yl-5-methylphenyl)pyridine;9-(6-methyl-4-phenyl-2-pyridinyl)carbazole;9-(3-methyl-5-pyridin-4-ylphenyl)carbazole.
What is the SMILES notation for 2-dibenzofuran-4-yl-6-methyl-4-phenylpyridine;4-(3-dibenzofuran-4-yl-5-methylphenyl)pyridine;4-(3-dibenzothiophen-4-yl-5-methylphenyl)pyridine;9-(6-methyl-4-phenyl-2-pyridinyl)carbazole;9-(3-methyl-5-pyridin-4-ylphenyl)carbazole?
The canonical SMILES for 2-dibenzofuran-4-yl-6-methyl-4-phenylpyridine;4-(3-dibenzofuran-4-yl-5-methylphenyl)pyridine;4-(3-dibenzothiophen-4-yl-5-methylphenyl)pyridine;9-(6-methyl-4-phenyl-2-pyridinyl)carbazole;9-(3-methyl-5-pyridin-4-ylphenyl)carbazole is Cc1cc(-c2ccccc2)cc(-c2cccc3c2oc2ccccc23)n1.Cc1cc(-c2ccccc2)cc(-n2c3ccccc3c3ccccc32)n1.Cc1cc(-c2ccncc2)cc(-c2cccc3c2oc2ccccc23)c1.Cc1cc(-c2ccncc2)cc(-c2cccc3c2sc2ccccc23)c1.Cc1cc(-c2ccncc2)cc(-n2c3ccccc3c3ccccc32)c1.
What is the InChIKey of 2-dibenzofuran-4-yl-6-methyl-4-phenylpyridine;4-(3-dibenzofuran-4-yl-5-methylphenyl)pyridine;4-(3-dibenzothiophen-4-yl-5-methylphenyl)pyridine;9-(6-methyl-4-phenyl-2-pyridinyl)carbazole;9-(3-methyl-5-pyridin-4-ylphenyl)carbazole?
The InChIKey is BRWZDLVYFZFGJW-UHFFFAOYSA-N. The full InChI is InChI=1S/2C24H18N2.2C24H17NO.C24H17NS/c1-17-14-19(18-10-12-25-13-11-18)16-20(15-17)26-23-8-4-2-6-21(23)22-7-3-5-9-24(22)26;1-17-15-19(18-9-3-2-4-10-18)16-24(25-17)26-22-13-7-5-11-20(22)21-12-6-8-14-23(21)26;1-16-13-18(17-9-11-25-12-10-17)15-19(14-16)20-6-4-7-22-21-5-2-3-8-23(21)26-24(20)22;1-16-14-18(17-8-3-2-4-9-17)15-22(25-16)21-12-7-11-20-19-10-5-6-13-23(19)26-24(20)21;1-16-13-18(17-9-11-25-12-10-17)15-19(14-16)20-6-4-7-22-21-5-2-3-8-23(21)26-24(20)22/h2*2-16H,1H3;3*2-15H,1H3.
What are the key properties of 2-dibenzofuran-4-yl-6-methyl-4-phenylpyridine;4-(3-dibenzofuran-4-yl-5-methylphenyl)pyridine;4-(3-dibenzothiophen-4-yl-5-methylphenyl)pyridine;9-(6-methyl-4-phenyl-2-pyridinyl)carbazole;9-(3-methyl-5-pyridin-4-ylphenyl)carbazole?
2-dibenzofuran-4-yl-6-methyl-4-phenylpyridine;4-(3-dibenzofuran-4-yl-5-methylphenyl)pyridine;4-(3-dibenzothiophen-4-yl-5-methylphenyl)pyridine;9-(6-methyl-4-phenyl-2-pyridinyl)carbazole;9-(3-methyl-5-pyridin-4-ylphenyl)carbazole has a molecular weight of 1691.13 g/mol, XLogP of 32.65, 10 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzofuran-4-yl-6-methyl-4-phenylpyridine;4-(3-dibenzofuran-4-yl-5-methylphenyl)pyridine;4-(3-dibenzothiophen-4-yl-5-methylphenyl)pyridine;9-(6-methyl-4-phenyl-2-pyridinyl)carbazole;9-(3-methyl-5-pyridin-4-ylphenyl)carbazole is sourced from PubChem (CID 157443051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).