chempirical

2-Chloro-4-(4-(naphthalen-1-yl)phenyl)-6-phenyl-1,3,5-triazine

C25H16ClN3CAS 2229752-36-5393.87 g/mol

Open in Covalent MOL file
NNNCl
Aryl halide

Properties

Molecular formula
C25H16ClN3
Molar mass
393.87 g/mol
Exact mass
393.1033 Da
logP
6.68Crippen estimate
Polar surface area
38.7 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
3

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
2229752-36-5
SMILES
C1=CC=C(C=C1)C2=NC(=NC(=N2)Cl)C3=CC=C(C=C3)C4=CC=CC5=CC=CC=C54
InChIKey
RLWRDIAZTFTCRY-UHFFFAOYSA-N
InChI
InChI=1S/C25H16ClN3/c26-25-28-23(19-8-2-1-3-9-19)27-24(29-25)20-15-13-18(14-16-20)22-12-6-10-17-7-4-5-11-21(17)22/h1-16H

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Work with 2-Chloro-4-(4-(naphthalen-1-yl)phenyl)-6-phenyl-1,3,5-triazine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-([1,1'-Biphenyl]-4-yl)-4-chloro-6-phenyl-1,3,5-triazine1472062-94-465 % similar 2,4-Bis([1,1'-biphenyl]-4-yl)-6-chloro-1,3,5-triazine182918-13-465 % similar 2-Chloro-4,6-diphenyl-1,3,5-triazine3842-55-563 % similar 1-Phenylnaphthalene605-02-763 % similar 2-Chloro-4-(naphthalen-2-yl)-6-phenyl-1,3,5-triazine1342819-12-863 % similar 2-(4-Biphenylyl)-4,6-dichloro-1,3,5-triazine10202-45-659 % similar 2,4-Dichloro-6-phenyl-1,3,5-triazine1700-02-358 % similar 1,3,5-Triazine,2-chloro-4-(1-dibenzofuranyl)-6-phenyl-1883265-32-455 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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