2,4-dichloro-6-(6-dibenzofuran-2-yldibenzofuran-2-yl)-1,3,5-triazine

C27H13Cl2N3O2 — CID 168908527

IUPAC2,4-dichloro-6-(6-dibenzofuran-2-yldibenzofuran-2-yl)-1,3,5-triazine
SMILESClc1nc(Cl)nc(-c2ccc3oc4c(-c5ccc6oc7ccccc7c6c5)cccc4c3c2)n1
InChIInChI=1S/C27H13Cl2N3O2/c28-26-30-25(31-27(29)32-26)15-9-11-23-20(13-15)18-6-3-5-16(24(18)34-23)14-8-10-22-19(12-14)17-4-1-2-7-21(17)33-22/h1-13H
InChIKeyRGASCJNUUIZNDW-UHFFFAOYSA-N
MW482.33 g/mol
LogP8.31
Rot. Bonds2

About 2,4-dichloro-6-(6-dibenzofuran-2-yldibenzofuran-2-yl)-1,3,5-triazine

2,4-dichloro-6-(6-dibenzofuran-2-yldibenzofuran-2-yl)-1,3,5-triazine (PubChem CID 168908527) has the molecular formula C27H13Cl2N3O2 and a molecular weight of 482.33 g/mol. Its IUPAC name is 2,4-dichloro-6-(6-dibenzofuran-2-yldibenzofuran-2-yl)-1,3,5-triazine.

Molecular Properties

Compound Name2,4-dichloro-6-(6-dibenzofuran-2-yldibenzofuran-2-yl)-1,3,5-triazine
PubChem CID168908527
Molecular FormulaC27H13Cl2N3O2
Molecular Weight482.33 g/mol
Exact Mass481.04
IUPAC Name2,4-dichloro-6-(6-dibenzofuran-2-yldibenzofuran-2-yl)-1,3,5-triazine
SMILESClc1nc(Cl)nc(-c2ccc3oc4c(-c5ccc6oc7ccccc7c6c5)cccc4c3c2)n1
InChIInChI=1S/C27H13Cl2N3O2/c28-26-30-25(31-27(29)32-26)15-9-11-23-20(13-15)18-6-3-5-16(24(18)34-23)14-8-10-22-19(12-14)17-4-1-2-7-21(17)33-22/h1-13H
InChIKeyRGASCJNUUIZNDW-UHFFFAOYSA-N
XLogP8.31
TPSA64.95 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500482.33
LogP ≤ 58.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-chloro-4-dibenzofuran-2-yl-6-dibenzofuran-4-yl-1,3,5-triazine
CID 155758027
2-(2-dibenzofuran-2-yl-5-dibenzofuran-4-ylphenyl)-4,6-diphenyl-1,3,5-triazine
CID 171402367
2-chloro-4-dibenzofuran-2-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine
CID 171439501
2-[6-(2-dibenzofuran-2-ylphenyl)dibenzofuran-3-yl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 170192190
2-[8-(2-dibenzofuran-4-ylphenyl)dibenzofuran-3-yl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 170192137
2-dibenzofuran-3-yl-4-[3-(8-phenyldibenzofuran-4-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazine
CID 168850264
2,4-diphenyl-6-[3-[8-(3-phenylphenyl)dibenzofuran-4-yl]phenyl]-1,3,5-triazine
CID 118651034
2,4-diphenyl-6-[6-[3-(4-phenylphenyl)phenyl]dibenzofuran-2-yl]-1,3,5-triazine
CID 166952873
2-chloro-4-dibenzofuran-4-yl-6-[3-(8-phenylnaphthalen-2-yl)phenyl]-1,3,5-triazine
CID 168845014
2-(6-dibenzofuran-2-yldibenzofuran-1-yl)-4,6-diphenyl-1,3,5-triazine
CID 146519914
2-chloro-6-dibenzofuran-4-yl-4-phenylquinazoline
CID 139327756
2-dibenzofuran-4-yl-4-[4-(1-dibenzofuran-2-yldibenzofuran-4-yl)phenyl]-6-phenyl-1,3,5-triazine
CID 155077824

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-6-(6-dibenzofuran-2-yldibenzofuran-2-yl)-1,3,5-triazine?
The IUPAC name of 2,4-dichloro-6-(6-dibenzofuran-2-yldibenzofuran-2-yl)-1,3,5-triazine (CID 168908527) is 2,4-dichloro-6-(6-dibenzofuran-2-yldibenzofuran-2-yl)-1,3,5-triazine.
What is the SMILES notation for 2,4-dichloro-6-(6-dibenzofuran-2-yldibenzofuran-2-yl)-1,3,5-triazine?
The canonical SMILES for 2,4-dichloro-6-(6-dibenzofuran-2-yldibenzofuran-2-yl)-1,3,5-triazine is Clc1nc(Cl)nc(-c2ccc3oc4c(-c5ccc6oc7ccccc7c6c5)cccc4c3c2)n1.
What is the InChIKey of 2,4-dichloro-6-(6-dibenzofuran-2-yldibenzofuran-2-yl)-1,3,5-triazine?
The InChIKey is RGASCJNUUIZNDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H13Cl2N3O2/c28-26-30-25(31-27(29)32-26)15-9-11-23-20(13-15)18-6-3-5-16(24(18)34-23)14-8-10-22-19(12-14)17-4-1-2-7-21(17)33-22/h1-13H.
What are the key properties of 2,4-dichloro-6-(6-dibenzofuran-2-yldibenzofuran-2-yl)-1,3,5-triazine?
2,4-dichloro-6-(6-dibenzofuran-2-yldibenzofuran-2-yl)-1,3,5-triazine has a molecular weight of 482.33 g/mol, XLogP of 8.31, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6-(6-dibenzofuran-2-yldibenzofuran-2-yl)-1,3,5-triazine is sourced from PubChem (CID 168908527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).