9-[4-(6-phenyldibenzofuran-2-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(6-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole

C123H76N12O3 — CID 164978383

IUPAC9-[4-(6-phenyldibenzofuran-2-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(6-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole
SMILESc1ccc(-c2ccc(-c3nc(-c4ccc5oc6c(-c7ccccc7)cccc6c5c4)nc(-n4c5ccccc5c5ccccc54)n3)cc2)cc1.c1ccc(-c2ccc3c(c2)oc2ccc(-c4nc(-c5ccccc5)nc(-n5c6ccccc6c6ccccc65)n4)cc23)cc1.c1ccc(-c2nc(-c3ccc4oc5c(-c6ccccc6)cccc5c4c3)nc(-n3c4ccccc4c4ccccc43)n2)cc1
InChIInChI=1S/C45H28N4O.2C39H24N4O/c1-3-12-29(13-4-1)30-22-24-32(25-23-30)43-46-44(48-45(47-43)49-39-20-9-7-16-35(39)36-17-8-10-21-40(36)49)33-26-27-41-38(28-33)37-19-11-18-34(42(37)50-41)31-14-5-2-6-15-31;1-3-12-25(13-4-1)28-18-11-19-31-32-24-27(22-23-35(32)44-36(28)31)38-40-37(26-14-5-2-6-15-26)41-39(42-38)43-33-20-9-7-16-29(33)30-17-8-10-21-34(30)43;1-3-11-25(12-4-1)27-19-21-31-32-23-28(20-22-35(32)44-36(31)24-27)38-40-37(26-13-5-2-6-14-26)41-39(42-38)43-33-17-9-7-15-29(33)30-16-8-10-18-34(30)43/h1-28H;2*1-24H
InChIKeyFCQXOZOBIBMVIB-UHFFFAOYSA-N
MW1770.04 g/mol
LogP31.27
Rot. Bonds13

About 9-[4-(6-phenyldibenzofuran-2-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(6-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole

9-[4-(6-phenyldibenzofuran-2-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(6-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole (PubChem CID 164978383) has the molecular formula C123H76N12O3 and a molecular weight of 1770.04 g/mol. Its IUPAC name is 9-[4-(6-phenyldibenzofuran-2-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(6-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole.

Molecular Properties

Compound Name9-[4-(6-phenyldibenzofuran-2-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(6-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole
PubChem CID164978383
Molecular FormulaC123H76N12O3
Molecular Weight1770.04 g/mol
Exact Mass1768.62
IUPAC Name9-[4-(6-phenyldibenzofuran-2-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(6-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole
SMILESc1ccc(-c2ccc(-c3nc(-c4ccc5oc6c(-c7ccccc7)cccc6c5c4)nc(-n4c5ccccc5c5ccccc54)n3)cc2)cc1.c1ccc(-c2ccc3c(c2)oc2ccc(-c4nc(-c5ccccc5)nc(-n5c6ccccc6c6ccccc65)n4)cc23)cc1.c1ccc(-c2nc(-c3ccc4oc5c(-c6ccccc6)cccc5c4c3)nc(-n3c4ccccc4c4ccccc43)n2)cc1
InChIInChI=1S/C45H28N4O.2C39H24N4O/c1-3-12-29(13-4-1)30-22-24-32(25-23-30)43-46-44(48-45(47-43)49-39-20-9-7-16-35(39)36-17-8-10-21-40(36)49)33-26-27-41-38(28-33)37-19-11-18-34(42(37)50-41)31-14-5-2-6-15-31;1-3-12-25(13-4-1)28-18-11-19-31-32-24-27(22-23-35(32)44-36(28)31)38-40-37(26-14-5-2-6-15-26)41-39(42-38)43-33-20-9-7-16-29(33)30-17-8-10-21-34(30)43;1-3-11-25(12-4-1)27-19-21-31-32-23-28(20-22-35(32)44-36(31)24-27)38-40-37(26-13-5-2-6-14-26)41-39(42-38)43-33-17-9-7-15-29(33)30-16-8-10-18-34(30)43/h1-28H;2*1-24H
InChIKeyFCQXOZOBIBMVIB-UHFFFAOYSA-N
XLogP31.27
TPSA170.22 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds13
Heavy Atoms138
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001770.04
LogP ≤ 531.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 9-[4-(6-phenyldibenzofuran-2-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(6-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-[4-(6-phenyldibenzofuran-2-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(6-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole?
The IUPAC name of 9-[4-(6-phenyldibenzofuran-2-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(6-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole (CID 164978383) is 9-[4-(6-phenyldibenzofuran-2-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(6-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole.
What is the SMILES notation for 9-[4-(6-phenyldibenzofuran-2-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(6-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole?
The canonical SMILES for 9-[4-(6-phenyldibenzofuran-2-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(6-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole is c1ccc(-c2ccc(-c3nc(-c4ccc5oc6c(-c7ccccc7)cccc6c5c4)nc(-n4c5ccccc5c5ccccc54)n3)cc2)cc1.c1ccc(-c2ccc3c(c2)oc2ccc(-c4nc(-c5ccccc5)nc(-n5c6ccccc6c6ccccc65)n4)cc23)cc1.c1ccc(-c2nc(-c3ccc4oc5c(-c6ccccc6)cccc5c4c3)nc(-n3c4ccccc4c4ccccc43)n2)cc1.
What is the InChIKey of 9-[4-(6-phenyldibenzofuran-2-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(6-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole?
The InChIKey is FCQXOZOBIBMVIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H28N4O.2C39H24N4O/c1-3-12-29(13-4-1)30-22-24-32(25-23-30)43-46-44(48-45(47-43)49-39-20-9-7-16-35(39)36-17-8-10-21-40(36)49)33-26-27-41-38(28-33)37-19-11-18-34(42(37)50-41)31-14-5-2-6-15-31;1-3-12-25(13-4-1)28-18-11-19-31-32-24-27(22-23-35(32)44-36(28)31)38-40-37(26-14-5-2-6-15-26)41-39(42-38)43-33-20-9-7-16-29(33)30-17-8-10-21-34(30)43;1-3-11-25(12-4-1)27-19-21-31-32-23-28(20-22-35(32)44-36(31)24-27)38-40-37(26-13-5-2-6-14-26)41-39(42-38)43-33-17-9-7-15-29(33)30-16-8-10-18-34(30)43/h1-28H;2*1-24H.
What are the key properties of 9-[4-(6-phenyldibenzofuran-2-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(6-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole?
9-[4-(6-phenyldibenzofuran-2-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(6-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole has a molecular weight of 1770.04 g/mol, XLogP of 31.27, 13 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-(6-phenyldibenzofuran-2-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(6-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole is sourced from PubChem (CID 164978383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).