2-nitro-4,6-diphenyl-1,3,5-triazine

C15H10N4O2 — CID 582148

IUPAC2-nitro-4,6-diphenyl-1,3,5-triazine
SMILESO=[N+]([O-])c1nc(-c2ccccc2)nc(-c2ccccc2)n1
InChIInChI=1S/C15H10N4O2/c20-19(21)15-17-13(11-7-3-1-4-8-11)16-14(18-15)12-9-5-2-6-10-12/h1-10H
InChIKeySUZNEURBUBRBCA-UHFFFAOYSA-N
MW278.27 g/mol
LogP3.11
Rot. Bonds3

About 2-nitro-4,6-diphenyl-1,3,5-triazine

2-nitro-4,6-diphenyl-1,3,5-triazine (PubChem CID 582148) has the molecular formula C15H10N4O2 and a molecular weight of 278.27 g/mol. Its IUPAC name is 2-nitro-4,6-diphenyl-1,3,5-triazine.

Molecular Properties

Compound Name2-nitro-4,6-diphenyl-1,3,5-triazine
PubChem CID582148
Molecular FormulaC15H10N4O2
Molecular Weight278.27 g/mol
Exact Mass278.08
IUPAC Name2-nitro-4,6-diphenyl-1,3,5-triazine
SMILESO=[N+]([O-])c1nc(-c2ccccc2)nc(-c2ccccc2)n1
InChIInChI=1S/C15H10N4O2/c20-19(21)15-17-13(11-7-3-1-4-8-11)16-14(18-15)12-9-5-2-6-10-12/h1-10H
InChIKeySUZNEURBUBRBCA-UHFFFAOYSA-N
XLogP3.11
TPSA81.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.27
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[4-[3-(3,5-diphenylphenyl)-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 58943623
2-[4-[3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-phenylphenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 58943296
2-(4-methylphenyl)-6-nitro-4-phenylquinazoline
CID 102342967
1,1'-biphenyl;1,3-dinitrobenzene
CID 174540087
4-N,6-N-dicyclopentyl-5-nitro-2-phenylpyrimidine-4,6-diamine
CID 10785195
6-chloro-2-(4-nitrophenyl)-4-phenylquinazoline
CID 15566178
6-nitro-3-phenyl-1,2,4-benzotriazine
CID 71332130
2,4-diphenyl-6-[3-[3-[3-[3-[4-phenyl-6-[3-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-[3-[3-[4-phenyl-6-[3-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-1,3,5-triazine
CID 157466607
2,4-bis[4-(3-phenylphenyl)phenyl]-6-[4-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,5-triazine
CID 166571194
2-[3-[3-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-[3-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-[3-[3-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 157455231
2,4-diphenyl-6-[3-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,5-triazine
CID 121311668
2-phenyl-4-(3-phenylphenyl)-6-[3-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,5-triazine
CID 122606669

Frequently Asked Questions

What is the IUPAC name of 2-nitro-4,6-diphenyl-1,3,5-triazine?
The IUPAC name of 2-nitro-4,6-diphenyl-1,3,5-triazine (CID 582148) is 2-nitro-4,6-diphenyl-1,3,5-triazine.
What is the SMILES notation for 2-nitro-4,6-diphenyl-1,3,5-triazine?
The canonical SMILES for 2-nitro-4,6-diphenyl-1,3,5-triazine is O=[N+]([O-])c1nc(-c2ccccc2)nc(-c2ccccc2)n1.
What is the InChIKey of 2-nitro-4,6-diphenyl-1,3,5-triazine?
The InChIKey is SUZNEURBUBRBCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N4O2/c20-19(21)15-17-13(11-7-3-1-4-8-11)16-14(18-15)12-9-5-2-6-10-12/h1-10H.
What are the key properties of 2-nitro-4,6-diphenyl-1,3,5-triazine?
2-nitro-4,6-diphenyl-1,3,5-triazine has a molecular weight of 278.27 g/mol, XLogP of 3.11, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-nitro-4,6-diphenyl-1,3,5-triazine is sourced from PubChem (CID 582148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).