6-[4-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-1,9-diphenylcarbazole

C51H32N4O — CID 155201179

IUPAC6-[4-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-1,9-diphenylcarbazole
SMILESc1ccc(-c2nc(-c3ccc(-c4ccc5c(c4)c4cccc(-c6ccccc6)c4n5-c4ccccc4)cc3)nc(-c3ccc4oc5ccccc5c4c3)n2)cc1
InChIInChI=1S/C51H32N4O/c1-4-13-34(14-5-1)40-20-12-21-42-43-31-37(27-29-45(43)55(48(40)42)39-17-8-3-9-18-39)33-23-25-36(26-24-33)50-52-49(35-15-6-2-7-16-35)53-51(54-50)38-28-30-47-44(32-38)41-19-10-11-22-46(41)56-47/h1-32H
InChIKeyVXCVOXJWIJOXQR-UHFFFAOYSA-N
MW716.84 g/mol
LogP13.20
Rot. Bonds6

About 6-[4-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-1,9-diphenylcarbazole

6-[4-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-1,9-diphenylcarbazole (PubChem CID 155201179) has the molecular formula C51H32N4O and a molecular weight of 716.84 g/mol. Its IUPAC name is 6-[4-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-1,9-diphenylcarbazole.

Molecular Properties

Compound Name6-[4-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-1,9-diphenylcarbazole
PubChem CID155201179
Molecular FormulaC51H32N4O
Molecular Weight716.84 g/mol
Exact Mass716.26
IUPAC Name6-[4-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-1,9-diphenylcarbazole
SMILESc1ccc(-c2nc(-c3ccc(-c4ccc5c(c4)c4cccc(-c6ccccc6)c4n5-c4ccccc4)cc3)nc(-c3ccc4oc5ccccc5c4c3)n2)cc1
InChIInChI=1S/C51H32N4O/c1-4-13-34(14-5-1)40-20-12-21-42-43-31-37(27-29-45(43)55(48(40)42)39-17-8-3-9-18-39)33-23-25-36(26-24-33)50-52-49(35-15-6-2-7-16-35)53-51(54-50)38-28-30-47-44(32-38)41-19-10-11-22-46(41)56-47/h1-32H
InChIKeyVXCVOXJWIJOXQR-UHFFFAOYSA-N
XLogP13.20
TPSA56.74 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500716.84
LogP ≤ 513.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-[3-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-1,9-diphenylcarbazole
CID 155201210
6-[4-[4,6-di(dibenzofuran-3-yl)-1,3,5-triazin-2-yl]phenyl]-1,9-diphenylcarbazole
CID 155201239
1-[7-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-6,9-diphenylcarbazole
CID 159616127
1-[7-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 139342651
1-[8-[4-[4-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]dibenzofuran-3-yl]-9-phenylcarbazole
CID 157480548
1-[7-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-6,9-diphenylcarbazole;1-[8-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-6,9-diphenylcarbazole;2-[7-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-6,9-diphenylcarbazole
CID 157292587
1-[3-[4-dibenzofuran-2-yl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]carbazol-9-yl]-9-(3-phenylphenyl)carbazole
CID 168807821
3-[4-dibenzofuran-2-yl-6-[2-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]-9-phenylcarbazole
CID 169280120
9-[4-(4-dibenzofuran-2-yl-6-dibenzofuran-4-yl-1,3,5-triazin-2-yl)phenyl]-3-phenylcarbazole
CID 170534356
1-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-1-yl]-6,9-diphenylcarbazole
CID 156549397
6-carbazol-9-yl-1-(3-dibenzofuran-2-ylphenyl)-9-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 142568463
9-(4-dibenzofuran-2-ylphenyl)-3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 118149414

Frequently Asked Questions

What is the IUPAC name of 6-[4-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-1,9-diphenylcarbazole?
The IUPAC name of 6-[4-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-1,9-diphenylcarbazole (CID 155201179) is 6-[4-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-1,9-diphenylcarbazole.
What is the SMILES notation for 6-[4-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-1,9-diphenylcarbazole?
The canonical SMILES for 6-[4-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-1,9-diphenylcarbazole is c1ccc(-c2nc(-c3ccc(-c4ccc5c(c4)c4cccc(-c6ccccc6)c4n5-c4ccccc4)cc3)nc(-c3ccc4oc5ccccc5c4c3)n2)cc1.
What is the InChIKey of 6-[4-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-1,9-diphenylcarbazole?
The InChIKey is VXCVOXJWIJOXQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H32N4O/c1-4-13-34(14-5-1)40-20-12-21-42-43-31-37(27-29-45(43)55(48(40)42)39-17-8-3-9-18-39)33-23-25-36(26-24-33)50-52-49(35-15-6-2-7-16-35)53-51(54-50)38-28-30-47-44(32-38)41-19-10-11-22-46(41)56-47/h1-32H.
What are the key properties of 6-[4-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-1,9-diphenylcarbazole?
6-[4-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-1,9-diphenylcarbazole has a molecular weight of 716.84 g/mol, XLogP of 13.20, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-1,9-diphenylcarbazole is sourced from PubChem (CID 155201179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).