5-(6-dibenzofuran-1-yl-4-phenyl-1,4-dihydro-1,3,5-triazin-2-yl)benzo[b]carbazole

C37H24N4O — CID 166915553

IUPAC5-(6-dibenzofuran-1-yl-4-phenyl-1,4-dihydro-1,3,5-triazin-2-yl)benzo[b]carbazole
SMILESc1ccc(C2N=C(c3cccc4oc5ccccc5c34)NC(n3c4ccccc4c4cc5ccccc5cc43)=N2)cc1
InChIInChI=1S/C37H24N4O/c1-2-11-23(12-3-1)35-38-36(28-17-10-20-33-34(28)27-16-7-9-19-32(27)42-33)40-37(39-35)41-30-18-8-6-15-26(30)29-21-24-13-4-5-14-25(24)22-31(29)41/h1-22,35H,(H,38,39,40)
InChIKeyKZAVMFVJFUNSGS-UHFFFAOYSA-N
MW540.63 g/mol
LogP8.80
Rot. Bonds2

About 5-(6-dibenzofuran-1-yl-4-phenyl-1,4-dihydro-1,3,5-triazin-2-yl)benzo[b]carbazole

5-(6-dibenzofuran-1-yl-4-phenyl-1,4-dihydro-1,3,5-triazin-2-yl)benzo[b]carbazole (PubChem CID 166915553) has the molecular formula C37H24N4O and a molecular weight of 540.63 g/mol. Its IUPAC name is 5-(6-dibenzofuran-1-yl-4-phenyl-1,4-dihydro-1,3,5-triazin-2-yl)benzo[b]carbazole.

Molecular Properties

Compound Name5-(6-dibenzofuran-1-yl-4-phenyl-1,4-dihydro-1,3,5-triazin-2-yl)benzo[b]carbazole
PubChem CID166915553
Molecular FormulaC37H24N4O
Molecular Weight540.63 g/mol
Exact Mass540.20
IUPAC Name5-(6-dibenzofuran-1-yl-4-phenyl-1,4-dihydro-1,3,5-triazin-2-yl)benzo[b]carbazole
SMILESc1ccc(C2N=C(c3cccc4oc5ccccc5c34)NC(n3c4ccccc4c4cc5ccccc5cc43)=N2)cc1
InChIInChI=1S/C37H24N4O/c1-2-11-23(12-3-1)35-38-36(28-17-10-20-33-34(28)27-16-7-9-19-32(27)42-33)40-37(39-35)41-30-18-8-6-15-26(30)29-21-24-13-4-5-14-25(24)22-31(29)41/h1-22,35H,(H,38,39,40)
InChIKeyKZAVMFVJFUNSGS-UHFFFAOYSA-N
XLogP8.80
TPSA54.82 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500540.63
LogP ≤ 58.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

7-(6-dibenzofuran-1-yl-4-phenyl-1,4-dihydro-1,3,5-triazin-2-yl)benzo[c]carbazole
CID 166915507
5-[2-dibenzofuran-1-yl-4-[2-phenyl-6-(2-phenylphenyl)-1,4-dihydro-1,3,5-triazin-4-yl]phenyl]benzo[b]carbazole
CID 155474982
9-[6-phenyl-4-(9-phenyldibenzofuran-3-yl)-1,4-dihydro-1,3,5-triazin-2-yl]carbazole
CID 174276647
5-[2-dibenzofuran-1-yl-4-[2-phenyl-6-(3-phenylphenyl)-1,4-dihydro-1,3,5-triazin-4-yl]phenyl]benzo[b]carbazole
CID 163570701
2-chloro-6-dibenzofuran-1-yl-4-phenyl-1,4-dihydro-1,3,5-triazine
CID 118888315
2-dibenzofuran-1-yl-6-naphthalen-2-yl-4-(4-naphthalen-1-ylphenyl)-1,4-dihydro-1,3,5-triazine
CID 171054220
5-[4-[4,6-di(dibenzofuran-1-yl)-1,3,5-triazin-2-yl]dibenzofuran-1-yl]benzo[b]carbazole
CID 166699659
5-[4-[2,6-di(anthracen-9-yl)-1,4-dihydro-1,3,5-triazin-4-yl]-2-dibenzofuran-4-ylphenyl]benzo[b]carbazole
CID 155475009
5-[3-(2-dibenzothiophen-1-yl-6-phenyl-1,4-dihydro-1,3,5-triazin-4-yl)dibenzofuran-4-yl]benzo[b]carbazole
CID 155037887
5-[2-dibenzofuran-4-yl-4-[2-(3-phenylphenyl)-6-(4-phenylphenyl)-1,4-dihydro-1,3,5-triazin-4-yl]phenyl]benzo[b]carbazole
CID 155475017
5-(3-dibenzofuran-1-ylquinoxalin-2-yl)benzo[b]carbazole
CID 139361976
2-(9-naphthalen-1-yldibenzofuran-3-yl)-4,6-diphenyl-1,4-dihydro-1,3,5-triazine
CID 166961458

Frequently Asked Questions

What is the IUPAC name of 5-(6-dibenzofuran-1-yl-4-phenyl-1,4-dihydro-1,3,5-triazin-2-yl)benzo[b]carbazole?
The IUPAC name of 5-(6-dibenzofuran-1-yl-4-phenyl-1,4-dihydro-1,3,5-triazin-2-yl)benzo[b]carbazole (CID 166915553) is 5-(6-dibenzofuran-1-yl-4-phenyl-1,4-dihydro-1,3,5-triazin-2-yl)benzo[b]carbazole.
What is the SMILES notation for 5-(6-dibenzofuran-1-yl-4-phenyl-1,4-dihydro-1,3,5-triazin-2-yl)benzo[b]carbazole?
The canonical SMILES for 5-(6-dibenzofuran-1-yl-4-phenyl-1,4-dihydro-1,3,5-triazin-2-yl)benzo[b]carbazole is c1ccc(C2N=C(c3cccc4oc5ccccc5c34)NC(n3c4ccccc4c4cc5ccccc5cc43)=N2)cc1.
What is the InChIKey of 5-(6-dibenzofuran-1-yl-4-phenyl-1,4-dihydro-1,3,5-triazin-2-yl)benzo[b]carbazole?
The InChIKey is KZAVMFVJFUNSGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H24N4O/c1-2-11-23(12-3-1)35-38-36(28-17-10-20-33-34(28)27-16-7-9-19-32(27)42-33)40-37(39-35)41-30-18-8-6-15-26(30)29-21-24-13-4-5-14-25(24)22-31(29)41/h1-22,35H,(H,38,39,40).
What are the key properties of 5-(6-dibenzofuran-1-yl-4-phenyl-1,4-dihydro-1,3,5-triazin-2-yl)benzo[b]carbazole?
5-(6-dibenzofuran-1-yl-4-phenyl-1,4-dihydro-1,3,5-triazin-2-yl)benzo[b]carbazole has a molecular weight of 540.63 g/mol, XLogP of 8.80, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-dibenzofuran-1-yl-4-phenyl-1,4-dihydro-1,3,5-triazin-2-yl)benzo[b]carbazole is sourced from PubChem (CID 166915553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).