1-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-ol

C31H21N3O — CID 156562288

IUPAC1-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-ol
SMILESOc1ccc2ccccc2c1-c1nc(-c2ccccc2)nc(-c2ccc(-c3ccccc3)cc2)n1
InChIInChI=1S/C31H21N3O/c35-27-20-19-23-11-7-8-14-26(23)28(27)31-33-29(24-12-5-2-6-13-24)32-30(34-31)25-17-15-22(16-18-25)21-9-3-1-4-10-21/h1-20,35H
InChIKeyJZPBOIUGQHQKJQ-UHFFFAOYSA-N
MW451.53 g/mol
LogP7.40
Rot. Bonds4

About 1-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-ol

1-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-ol (PubChem CID 156562288) has the molecular formula C31H21N3O and a molecular weight of 451.53 g/mol. Its IUPAC name is 1-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-ol.

Molecular Properties

Compound Name1-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-ol
PubChem CID156562288
Molecular FormulaC31H21N3O
Molecular Weight451.53 g/mol
Exact Mass451.17
IUPAC Name1-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-ol
SMILESOc1ccc2ccccc2c1-c1nc(-c2ccccc2)nc(-c2ccc(-c3ccccc3)cc2)n1
InChIInChI=1S/C31H21N3O/c35-27-20-19-23-11-7-8-14-26(23)28(27)31-33-29(24-12-5-2-6-13-24)32-30(34-31)25-17-15-22(16-18-25)21-9-3-1-4-10-21/h1-20,35H
InChIKeyJZPBOIUGQHQKJQ-UHFFFAOYSA-N
XLogP7.40
TPSA58.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500451.53
LogP ≤ 57.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine
CID 166656403
1-[4,6-bis(4-phenoxyphenyl)-1,3,5-triazin-2-yl]naphthalen-2-ol;2-chloro-4,6-bis(4-phenoxyphenyl)-1,3,5-triazine;naphthalen-2-ol
CID 157063536
2-[2-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]naphthalen-1-yl]-4,6-diphenyl-1,3,5-triazine
CID 170277591
2-(4-benzo[a]anthracen-7-ylphenyl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 167252711
2-(1-phenylnaphthalen-2-yl)-4-(4-phenylnaphthalen-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 176632434
2,4-diphenyl-6-[6-[4-phenyl-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3,5-triazine
CID 176632194
1-(4-aminophenyl)naphthalen-2-ol
CID 71327010
2,4-diphenyl-6-[4-[2-(4-phenylnaphthalen-1-yl)naphthalen-1-yl]phenyl]-1,3,5-triazine
CID 155105161
2-naphthalen-2-yl-4-phenyl-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazine
CID 165027661
2,4-di(chrysen-3-yl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 157117117
3-(4-phenanthren-3-yl-6-phenyl-1,3,5-triazin-2-yl)-2-[2-(2-phenylphenyl)phenyl]phenol
CID 170926556
2,4-diphenyl-6-[1-[4-[6-phenyl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]naphthalen-2-yl]-1,3,5-triazine
CID 129101509

Frequently Asked Questions

What is the IUPAC name of 1-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-ol?
The IUPAC name of 1-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-ol (CID 156562288) is 1-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-ol.
What is the SMILES notation for 1-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-ol?
The canonical SMILES for 1-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-ol is Oc1ccc2ccccc2c1-c1nc(-c2ccccc2)nc(-c2ccc(-c3ccccc3)cc2)n1.
What is the InChIKey of 1-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-ol?
The InChIKey is JZPBOIUGQHQKJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H21N3O/c35-27-20-19-23-11-7-8-14-26(23)28(27)31-33-29(24-12-5-2-6-13-24)32-30(34-31)25-17-15-22(16-18-25)21-9-3-1-4-10-21/h1-20,35H.
What are the key properties of 1-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-ol?
1-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-ol has a molecular weight of 451.53 g/mol, XLogP of 7.40, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-ol is sourced from PubChem (CID 156562288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).