9-[4-dibenzofuran-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;4-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)carbazole

C117H72N12O3 — CID 164984406

IUPAC9-[4-dibenzofuran-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;4-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)carbazole
SMILESc1ccc(-c2ccc(-c3nc(-c4cccc5c4oc4ccccc45)nc(-c4cccc5c4c4ccccc4n5-c4ccccc4)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4cccc5oc6ccccc6c45)nc(-n4c5ccccc5c5ccccc54)n3)cc2)cc1.c1ccc(-c2nc(-c3cccc4oc5ccccc5c34)nc(-n3c4ccccc4c4ccccc43)n2)cc1
InChIInChI=1S/C45H28N4O.C39H24N4O.C33H20N4O/c1-3-13-29(14-4-1)30-25-27-31(28-26-30)43-46-44(48-45(47-43)37-21-11-19-34-33-17-8-10-24-40(33)50-42(34)37)36-20-12-23-39-41(36)35-18-7-9-22-38(35)49(39)32-15-5-2-6-16-32;1-2-11-25(12-3-1)26-21-23-27(24-22-26)37-40-38(31-16-10-20-35-36(31)30-15-6-9-19-34(30)44-35)42-39(41-37)43-32-17-7-4-13-28(32)29-14-5-8-18-33(29)43;1-2-11-21(12-3-1)31-34-32(25-16-10-20-29-30(25)24-15-6-9-19-28(24)38-29)36-33(35-31)37-26-17-7-4-13-22(26)23-14-5-8-18-27(23)37/h1-28H;1-24H;1-20H
InChIKeyFYIOEHUHVWCXOR-UHFFFAOYSA-N
MW1693.94 g/mol
LogP29.61
Rot. Bonds12

About 9-[4-dibenzofuran-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;4-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)carbazole

9-[4-dibenzofuran-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;4-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)carbazole (PubChem CID 164984406) has the molecular formula C117H72N12O3 and a molecular weight of 1693.94 g/mol. Its IUPAC name is 9-[4-dibenzofuran-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;4-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)carbazole.

Molecular Properties

Compound Name9-[4-dibenzofuran-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;4-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)carbazole
PubChem CID164984406
Molecular FormulaC117H72N12O3
Molecular Weight1693.94 g/mol
Exact Mass1692.59
IUPAC Name9-[4-dibenzofuran-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;4-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)carbazole
SMILESc1ccc(-c2ccc(-c3nc(-c4cccc5c4oc4ccccc45)nc(-c4cccc5c4c4ccccc4n5-c4ccccc4)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4cccc5oc6ccccc6c45)nc(-n4c5ccccc5c5ccccc54)n3)cc2)cc1.c1ccc(-c2nc(-c3cccc4oc5ccccc5c34)nc(-n3c4ccccc4c4ccccc43)n2)cc1
InChIInChI=1S/C45H28N4O.C39H24N4O.C33H20N4O/c1-3-13-29(14-4-1)30-25-27-31(28-26-30)43-46-44(48-45(47-43)37-21-11-19-34-33-17-8-10-24-40(33)50-42(34)37)36-20-12-23-39-41(36)35-18-7-9-22-38(35)49(39)32-15-5-2-6-16-32;1-2-11-25(12-3-1)26-21-23-27(24-22-26)37-40-38(31-16-10-20-35-36(31)30-15-6-9-19-34(30)44-35)42-39(41-37)43-32-17-7-4-13-28(32)29-14-5-8-18-33(29)43;1-2-11-21(12-3-1)31-34-32(25-16-10-20-29-30(25)24-15-6-9-19-28(24)38-29)36-33(35-31)37-26-17-7-4-13-22(26)23-14-5-8-18-27(23)37/h1-28H;1-24H;1-20H
InChIKeyFYIOEHUHVWCXOR-UHFFFAOYSA-N
XLogP29.61
TPSA170.22 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds12
Heavy Atoms132
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001693.94
LogP ≤ 529.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 9-[4-dibenzofuran-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;4-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-[4-dibenzofuran-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;4-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)carbazole?
The IUPAC name of 9-[4-dibenzofuran-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;4-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)carbazole (CID 164984406) is 9-[4-dibenzofuran-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;4-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)carbazole.
What is the SMILES notation for 9-[4-dibenzofuran-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;4-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)carbazole?
The canonical SMILES for 9-[4-dibenzofuran-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;4-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)carbazole is c1ccc(-c2ccc(-c3nc(-c4cccc5c4oc4ccccc45)nc(-c4cccc5c4c4ccccc4n5-c4ccccc4)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4cccc5oc6ccccc6c45)nc(-n4c5ccccc5c5ccccc54)n3)cc2)cc1.c1ccc(-c2nc(-c3cccc4oc5ccccc5c34)nc(-n3c4ccccc4c4ccccc43)n2)cc1.
What is the InChIKey of 9-[4-dibenzofuran-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;4-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)carbazole?
The InChIKey is FYIOEHUHVWCXOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H28N4O.C39H24N4O.C33H20N4O/c1-3-13-29(14-4-1)30-25-27-31(28-26-30)43-46-44(48-45(47-43)37-21-11-19-34-33-17-8-10-24-40(33)50-42(34)37)36-20-12-23-39-41(36)35-18-7-9-22-38(35)49(39)32-15-5-2-6-16-32;1-2-11-25(12-3-1)26-21-23-27(24-22-26)37-40-38(31-16-10-20-35-36(31)30-15-6-9-19-34(30)44-35)42-39(41-37)43-32-17-7-4-13-28(32)29-14-5-8-18-33(29)43;1-2-11-21(12-3-1)31-34-32(25-16-10-20-29-30(25)24-15-6-9-19-28(24)38-29)36-33(35-31)37-26-17-7-4-13-22(26)23-14-5-8-18-27(23)37/h1-28H;1-24H;1-20H.
What are the key properties of 9-[4-dibenzofuran-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;4-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)carbazole?
9-[4-dibenzofuran-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;4-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)carbazole has a molecular weight of 1693.94 g/mol, XLogP of 29.61, 12 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-dibenzofuran-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;4-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)carbazole is sourced from PubChem (CID 164984406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).