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

C25H16ClN3 — CID 155151397

IUPAC2-(3-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine
SMILESClc1cc2ccccc2cc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1
InChIInChI=1S/C25H16ClN3/c26-22-16-20-14-8-7-13-19(20)15-21(22)25-28-23(17-9-3-1-4-10-17)27-24(29-25)18-11-5-2-6-12-18/h1-16H
InChIKeyGDKMJVSEOZISIA-UHFFFAOYSA-N
MW393.88 g/mol
LogP6.68
Rot. Bonds3

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

2-(3-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine (PubChem CID 155151397) has the molecular formula C25H16ClN3 and a molecular weight of 393.88 g/mol. Its IUPAC name is 2-(3-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine.

Molecular Properties

Compound Name2-(3-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine
PubChem CID155151397
Molecular FormulaC25H16ClN3
Molecular Weight393.88 g/mol
Exact Mass393.10
IUPAC Name2-(3-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine
SMILESClc1cc2ccccc2cc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1
InChIInChI=1S/C25H16ClN3/c26-22-16-20-14-8-7-13-19(20)15-21(22)25-28-23(17-9-3-1-4-10-17)27-24(29-25)18-11-5-2-6-12-18/h1-16H
InChIKeyGDKMJVSEOZISIA-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-(2-chloro-5-phenylphenyl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 175256430
2-chloro-4-phenanthren-9-yl-6-phenyl-1,3,5-triazine
CID 123546565
2-(2-chlorophenyl)-4-phenyl-6-(2-phenylphenyl)-1,3,5-triazine
CID 155151395
2-chloro-4-naphthalen-2-yl-6-(3-phenylnaphthalen-2-yl)-1,3,5-triazine
CID 164745875
2-chloro-4-(2-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 171731283
2-(2,5-diphenylphenyl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 171052509
2-(4-chloro-3-phenylphenyl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 171854007
2-[3-[3-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(2-phenylphenyl)-1,3,5-triazine;2-[3-[3-[3-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-4,6-bis(2-phenylphenyl)-1,3,5-triazine;2-[3-[3-[3-[3-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]-4,6-bis(2-phenylphenyl)-1,3,5-triazine;2-phenyl-4-(2-phenylphenyl)-6-[3-[3-[3-[3-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(2-phenylphenyl)-6-[3-[3-[3-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(2-phenylphenyl)-6-[3-[3-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-1,3,5-triazine
CID 165007118
2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-4-phenyl-6-(2-phenylphenyl)-1,3,5-triazine
CID 165078366
2,4-diphenyl-6-[3-(4-triphenylen-2-ylphenyl)naphthalen-2-yl]-1,3,5-triazine
CID 129099661
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
2-(2-chlorophenyl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine
CID 142752418

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine?
The IUPAC name of 2-(3-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine (CID 155151397) is 2-(3-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine.
What is the SMILES notation for 2-(3-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine?
The canonical SMILES for 2-(3-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine is Clc1cc2ccccc2cc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1.
What is the InChIKey of 2-(3-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine?
The InChIKey is GDKMJVSEOZISIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H16ClN3/c26-22-16-20-14-8-7-13-19(20)15-21(22)25-28-23(17-9-3-1-4-10-17)27-24(29-25)18-11-5-2-6-12-18/h1-16H.
What are the key properties of 2-(3-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine?
2-(3-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-(3-chloronaphthalen-2-yl)-4,6-diphenyl-1,3,5-triazine is sourced from PubChem (CID 155151397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).