4-dibenzofuran-2-yl-N,N,6-tri(dibenzofuran-3-yl)-1,3,5-triazin-2-amine

C51H28N4O4 — CID 171726990

IUPAC4-dibenzofuran-2-yl-N,N,6-tri(dibenzofuran-3-yl)-1,3,5-triazin-2-amine
SMILESc1ccc2c(c1)oc1cc(-c3nc(-c4ccc5oc6ccccc6c5c4)nc(N(c4ccc5c(c4)oc4ccccc45)c4ccc5c(c4)oc4ccccc45)n3)ccc12
InChIInChI=1S/C51H28N4O4/c1-5-13-41-33(9-1)37-21-17-30(26-46(37)57-41)50-52-49(29-18-24-45-40(25-29)36-12-4-8-16-44(36)56-45)53-51(54-50)55(31-19-22-38-34-10-2-6-14-42(34)58-47(38)27-31)32-20-23-39-35-11-3-7-15-43(35)59-48(39)28-32/h1-28H
InChIKeyGANMHTXLPGVEMC-UHFFFAOYSA-N
MW760.81 g/mol
LogP14.27
Rot. Bonds5

About 4-dibenzofuran-2-yl-N,N,6-tri(dibenzofuran-3-yl)-1,3,5-triazin-2-amine

4-dibenzofuran-2-yl-N,N,6-tri(dibenzofuran-3-yl)-1,3,5-triazin-2-amine (PubChem CID 171726990) has the molecular formula C51H28N4O4 and a molecular weight of 760.81 g/mol. Its IUPAC name is 4-dibenzofuran-2-yl-N,N,6-tri(dibenzofuran-3-yl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-dibenzofuran-2-yl-N,N,6-tri(dibenzofuran-3-yl)-1,3,5-triazin-2-amine
PubChem CID171726990
Molecular FormulaC51H28N4O4
Molecular Weight760.81 g/mol
Exact Mass760.21
IUPAC Name4-dibenzofuran-2-yl-N,N,6-tri(dibenzofuran-3-yl)-1,3,5-triazin-2-amine
SMILESc1ccc2c(c1)oc1cc(-c3nc(-c4ccc5oc6ccccc6c5c4)nc(N(c4ccc5c(c4)oc4ccccc45)c4ccc5c(c4)oc4ccccc45)n3)ccc12
InChIInChI=1S/C51H28N4O4/c1-5-13-41-33(9-1)37-21-17-30(26-46(37)57-41)50-52-49(29-18-24-45-40(25-29)36-12-4-8-16-44(36)56-45)53-51(54-50)55(31-19-22-38-34-10-2-6-14-42(34)58-47(38)27-31)32-20-23-39-35-11-3-7-15-43(35)59-48(39)28-32/h1-28H
InChIKeyGANMHTXLPGVEMC-UHFFFAOYSA-N
XLogP14.27
TPSA94.47 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms59
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500760.81
LogP ≤ 514.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 4-dibenzofuran-2-yl-N,N,6-tri(dibenzofuran-3-yl)-1,3,5-triazin-2-amine with MolForge

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Related Compounds

N,4-di(dibenzofuran-2-yl)-N,6-di(dibenzofuran-3-yl)-1,3,5-triazin-2-amine
CID 171726991
4-dibenzofuran-2-yl-N,N-di(dibenzofuran-3-yl)-6-dibenzofuran-4-yl-1,3,5-triazin-2-amine
CID 171727253
N-dibenzofuran-1-yl-4-dibenzofuran-2-yl-N-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-amine
CID 171727085
7-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)-N-phenyl-N-(4-phenylphenyl)dibenzofuran-3-amine
CID 170095890
4-dibenzofuran-2-yl-6-dibenzofuran-3-yl-N-dibenzofuran-4-yl-N-phenyl-1,3,5-triazin-2-amine
CID 171726902
N,N-di(dibenzofuran-1-yl)-4,6-di(dibenzofuran-2-yl)-1,3,5-triazin-2-amine
CID 171727191
2-(7-dibenzofuran-3-yldibenzofuran-2-yl)-4,6-diphenyl-1,3,5-triazine
CID 166953288
2-dibenzofuran-2-yl-4,6-bis(7-dibenzofuran-2-yldibenzofuran-1-yl)-1,3,5-triazine
CID 156522941
2-[7-(4-dibenzofuran-2-ylphenyl)dibenzofuran-3-yl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 166009557
2-dibenzofuran-3-yl-4-phenyl-6-[8-(4-phenylphenyl)dibenzofuran-2-yl]-1,3,5-triazine
CID 166953269
2,4-di(dibenzofuran-2-yl)-6-dibenzofuran-3-ylpyrimidine
CID 138736794
N-phenyl-N-[4-[8-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]phenyl]naphthalen-2-amine
CID 170093374

Frequently Asked Questions

What is the IUPAC name of 4-dibenzofuran-2-yl-N,N,6-tri(dibenzofuran-3-yl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-dibenzofuran-2-yl-N,N,6-tri(dibenzofuran-3-yl)-1,3,5-triazin-2-amine (CID 171726990) is 4-dibenzofuran-2-yl-N,N,6-tri(dibenzofuran-3-yl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-dibenzofuran-2-yl-N,N,6-tri(dibenzofuran-3-yl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-dibenzofuran-2-yl-N,N,6-tri(dibenzofuran-3-yl)-1,3,5-triazin-2-amine is c1ccc2c(c1)oc1cc(-c3nc(-c4ccc5oc6ccccc6c5c4)nc(N(c4ccc5c(c4)oc4ccccc45)c4ccc5c(c4)oc4ccccc45)n3)ccc12.
What is the InChIKey of 4-dibenzofuran-2-yl-N,N,6-tri(dibenzofuran-3-yl)-1,3,5-triazin-2-amine?
The InChIKey is GANMHTXLPGVEMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H28N4O4/c1-5-13-41-33(9-1)37-21-17-30(26-46(37)57-41)50-52-49(29-18-24-45-40(25-29)36-12-4-8-16-44(36)56-45)53-51(54-50)55(31-19-22-38-34-10-2-6-14-42(34)58-47(38)27-31)32-20-23-39-35-11-3-7-15-43(35)59-48(39)28-32/h1-28H.
What are the key properties of 4-dibenzofuran-2-yl-N,N,6-tri(dibenzofuran-3-yl)-1,3,5-triazin-2-amine?
4-dibenzofuran-2-yl-N,N,6-tri(dibenzofuran-3-yl)-1,3,5-triazin-2-amine has a molecular weight of 760.81 g/mol, XLogP of 14.27, 5 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-dibenzofuran-2-yl-N,N,6-tri(dibenzofuran-3-yl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 171726990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).