2-dibenzofuran-4-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole;2-dibenzothiophen-4-yl-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole

C88H54N10OS — CID 157388148

IUPAC2-dibenzofuran-4-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole;2-dibenzothiophen-4-yl-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5ccc(-c6cccc7c6sc6ccccc67)cc54)nc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccnc3-n3c4ccccc4c4ccc(-c5cccc6c5oc5ccccc56)cc43)n2)cc1
InChIInChI=1S/C44H27N5O.C44H27N5S/c1-3-13-28(14-4-1)41-46-42(29-15-5-2-6-16-29)48-43(47-41)36-21-12-26-45-44(36)49-37-22-9-7-17-32(37)33-25-24-30(27-38(33)49)31-19-11-20-35-34-18-8-10-23-39(34)50-40(31)35;1-3-12-28(13-4-1)42-46-43(29-14-5-2-6-15-29)48-44(47-42)31-23-25-40(45-27-31)49-37-20-9-7-16-33(37)34-24-22-30(26-38(34)49)32-18-11-19-36-35-17-8-10-21-39(35)50-41(32)36/h2*1-27H
InChIKeyBLRGFQULBCWESV-UHFFFAOYSA-N
MW1299.54 g/mol
LogP22.33
Rot. Bonds10

About 2-dibenzofuran-4-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole;2-dibenzothiophen-4-yl-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole

2-dibenzofuran-4-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole;2-dibenzothiophen-4-yl-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole (PubChem CID 157388148) has the molecular formula C88H54N10OS and a molecular weight of 1299.54 g/mol. Its IUPAC name is 2-dibenzofuran-4-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole;2-dibenzothiophen-4-yl-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole.

Molecular Properties

Compound Name2-dibenzofuran-4-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole;2-dibenzothiophen-4-yl-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole
PubChem CID157388148
Molecular FormulaC88H54N10OS
Molecular Weight1299.54 g/mol
Exact Mass1298.42
IUPAC Name2-dibenzofuran-4-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole;2-dibenzothiophen-4-yl-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5ccc(-c6cccc7c6sc6ccccc67)cc54)nc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccnc3-n3c4ccccc4c4ccc(-c5cccc6c5oc5ccccc56)cc43)n2)cc1
InChIInChI=1S/C44H27N5O.C44H27N5S/c1-3-13-28(14-4-1)41-46-42(29-15-5-2-6-16-29)48-43(47-41)36-21-12-26-45-44(36)49-37-22-9-7-17-32(37)33-25-24-30(27-38(33)49)31-19-11-20-35-34-18-8-10-23-39(34)50-40(31)35;1-3-12-28(13-4-1)42-46-43(29-14-5-2-6-15-29)48-44(47-42)31-23-25-40(45-27-31)49-37-20-9-7-16-33(37)34-24-22-30(26-38(34)49)32-18-11-19-36-35-17-8-10-21-39(35)50-41(32)36/h2*1-27H
InChIKeyBLRGFQULBCWESV-UHFFFAOYSA-N
XLogP22.33
TPSA126.12 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds10
Heavy Atoms100
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001299.54
LogP ≤ 522.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 2-dibenzofuran-4-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole;2-dibenzothiophen-4-yl-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole with MolForge

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Related Compounds

2-dibenzofuran-4-yl-9-[2-phenyl-4-[4-phenyl-6-[3-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-4-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylphenyl]carbazole
CID 165073222
2-dibenzofuran-4-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;2-dibenzofuran-4-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;2-dibenzofuran-4-yl-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole
CID 165036861
2-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-9-phenylcarbazole
CID 168768047
3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazole;2-dibenzofuran-4-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazole
CID 158797000
2-(4-dibenzofuran-4-ylphenyl)-4-(3-dibenzothiophen-4-ylphenyl)-6-phenyl-1,3,5-triazine
CID 130288940
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-[7-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-1-yl]-9-phenylcarbazole;2-[7-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-9-phenylcarbazole;2-[7-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-3-yl]-9-phenylcarbazole;2-[7-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-9-phenylcarbazole
CID 159094409
2-dibenzofuran-3-yl-7-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazole;2-dibenzothiophen-3-yl-7-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazole;2-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole;2-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-9-phenylcarbazole;3-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-9-phenylcarbazole
CID 161448697
3-[7-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole
CID 166952314
3-[4-(3-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;2-[3-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-9-phenylcarbazole;4-[4-(3-dibenzothiophen-3-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole
CID 161402392
3-[8-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole
CID 158230973

Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-4-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole;2-dibenzothiophen-4-yl-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole?
The IUPAC name of 2-dibenzofuran-4-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole;2-dibenzothiophen-4-yl-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole (CID 157388148) is 2-dibenzofuran-4-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole;2-dibenzothiophen-4-yl-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole.
What is the SMILES notation for 2-dibenzofuran-4-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole;2-dibenzothiophen-4-yl-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole?
The canonical SMILES for 2-dibenzofuran-4-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole;2-dibenzothiophen-4-yl-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole is c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5ccc(-c6cccc7c6sc6ccccc67)cc54)nc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccnc3-n3c4ccccc4c4ccc(-c5cccc6c5oc5ccccc56)cc43)n2)cc1.
What is the InChIKey of 2-dibenzofuran-4-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole;2-dibenzothiophen-4-yl-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole?
The InChIKey is BLRGFQULBCWESV-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H27N5O.C44H27N5S/c1-3-13-28(14-4-1)41-46-42(29-15-5-2-6-16-29)48-43(47-41)36-21-12-26-45-44(36)49-37-22-9-7-17-32(37)33-25-24-30(27-38(33)49)31-19-11-20-35-34-18-8-10-23-39(34)50-40(31)35;1-3-12-28(13-4-1)42-46-43(29-14-5-2-6-15-29)48-44(47-42)31-23-25-40(45-27-31)49-37-20-9-7-16-33(37)34-24-22-30(26-38(34)49)32-18-11-19-36-35-17-8-10-21-39(35)50-41(32)36/h2*1-27H.
What are the key properties of 2-dibenzofuran-4-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole;2-dibenzothiophen-4-yl-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole?
2-dibenzofuran-4-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole;2-dibenzothiophen-4-yl-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole has a molecular weight of 1299.54 g/mol, XLogP of 22.33, 10 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzofuran-4-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole;2-dibenzothiophen-4-yl-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole is sourced from PubChem (CID 157388148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).