2-(6-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine

C25H16ClN3 — CID 129263325

IUPAC2-(6-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine
SMILESClc1ccc2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc2c1
InChIInChI=1S/C25H16ClN3/c26-22-14-13-19-15-21(12-11-20(19)16-22)25-28-23(17-7-3-1-4-8-17)27-24(29-25)18-9-5-2-6-10-18/h1-16H
InChIKeySSBQOCJDENZIGU-UHFFFAOYSA-N
MW393.88 g/mol
LogP6.68
Rot. Bonds3

About 2-(6-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine

2-(6-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine (PubChem CID 129263325) has the molecular formula C25H16ClN3 and a molecular weight of 393.88 g/mol. Its IUPAC name is 2-(6-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine.

Molecular Properties

Compound Name2-(6-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine
PubChem CID129263325
Molecular FormulaC25H16ClN3
Molecular Weight393.88 g/mol
Exact Mass393.10
IUPAC Name2-(6-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine
SMILESClc1ccc2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc2c1
InChIInChI=1S/C25H16ClN3/c26-22-14-13-19-15-21(12-11-20(19)16-22)25-28-23(17-7-3-1-4-8-17)27-24(29-25)18-9-5-2-6-10-18/h1-16H
InChIKeySSBQOCJDENZIGU-UHFFFAOYSA-N
XLogP6.68
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500393.88
LogP ≤ 56.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-(6-chloronaphthalen-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine
CID 154696620
2-[4-(3-chlorophenyl)phenyl]-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine
CID 166916408
2-(2-bromo-4-chlorophenyl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine
CID 145377699
2-[4-[6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-2-yl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 18787948
2,4-diphenyl-6-[4-(6-phenylnaphthalen-2-yl)phenyl]-1,3,5-triazine
CID 166737815
2-(4-chlorophenyl)-4-phenyl-6-[3-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,5-triazine
CID 142425295
2-chloro-4-[3-(6-phenylnaphthalen-2-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazine
CID 166022207
2-(4-naphthalen-2-ylphenyl)-4-phenyl-6-(6-phenylnaphthalen-2-yl)-1,3,5-triazine
CID 170180018
2-[3-[6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-2-yl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 139339089
2-(4-chlorophenyl)-4-phenyl-6-[4-[3-(4-phenylphenyl)phenyl]phenyl]-1,3,5-triazine
CID 142425266
2-chloro-4-[3-(6-phenylnaphthalen-2-yl)phenyl]-6-(3-phenylphenyl)-1,3,5-triazine
CID 166022200
2-[3-[4-chloro-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 177250533

Frequently Asked Questions

What is the IUPAC name of 2-(6-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine?
The IUPAC name of 2-(6-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine (CID 129263325) is 2-(6-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine.
What is the SMILES notation for 2-(6-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine?
The canonical SMILES for 2-(6-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine is Clc1ccc2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc2c1.
What is the InChIKey of 2-(6-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine?
The InChIKey is SSBQOCJDENZIGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H16ClN3/c26-22-14-13-19-15-21(12-11-20(19)16-22)25-28-23(17-7-3-1-4-8-17)27-24(29-25)18-9-5-2-6-10-18/h1-16H.
What are the key properties of 2-(6-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine?
2-(6-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine has a molecular weight of 393.88 g/mol, XLogP of 6.68, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine is sourced from PubChem (CID 129263325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).