4-(Biphenyl-4-yl)-6-chloro-2-phenylpyrimidine

C₂₂H₁₅ClN₂CAS 1689538-58-6342.83 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₂₂H₁₅ClN₂
Molar mass: 342.83 g/mol
Exact mass: 342.0924 Da
logP: 6.13Crippen estimate
Polar surface area: 25.8 Å²
H-bond donors / acceptors: 0 / 2
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

1689538-58-6

SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC(=NC(=N3)C4=CC=CC=C4)Cl

InChIKey

JWWMUTCXVNBWGP-UHFFFAOYSA-N

InChI

InChI=1S/C22H15ClN2/c23-21-15-20(24-22(25-21)19-9-5-2-6-10-19)18-13-11-17(12-14-18)16-7-3-1-4-8-16/h1-15H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

4-([1,1'-Biphenyl]-4-yl)-6-chloro-2-phenylpyrimidine

Work with 4-(Biphenyl-4-yl)-6-chloro-2-phenylpyrimidine

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

4-Chloro-2,6-diphenylpyrimidine29509-91-992 % similar Fenclorim3740-92-974 % similar 2,4-Dichloro-6-phenylpyrimidine26032-72-467 % similar 2-(4-Biphenylyl)-4,6-dichloro-1,3,5-triazine10202-45-657 % similar 2-([1,1'-Biphenyl]-4-yl)-4-chloro-6-phenyl-1,3,5-triazine1472062-94-457 % similar 2,4-Bis([1,1'-biphenyl]-4-yl)-6-chloro-1,3,5-triazine182918-13-457 % similar 2,4,6-Tribiphenyl-4-yl-1,3,5-triazine31274-51-856 % similar 4-(4-Bromophenyl)-2,6-diphenylpyrimidine58536-46-255 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook