4-Chloro-7-methoxy-2-phenylquinoline

C16H12ClNOCAS 189816-05-5269.73 g/mol

Open in Covalent MOL file
OClN
Aryl halideEther

Properties

Molecular formula
C16H12ClNO
Molar mass
269.73 g/mol
Exact mass
269.0607 Da
Melting point
101–101.5 °C
logP
4.56Crippen estimate
Polar surface area
22.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Hazards

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

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Identifiers

CAS number
189816-05-5
SMILES
COc1ccc2c(Cl)cc(-c3ccccc3)nc2c1
InChIKey
BAZSITKSXXHTNS-UHFFFAOYSA-N
InChI
InChI=1S/C16H12ClNO/c1-19-12-7-8-13-14(17)10-15(18-16(13)9-12)11-5-3-2-4-6-11/h2-10H,1H3

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Names and synonyms

2 names
  • Quinoline, 4-chloro-7-methoxy-2-phenyl-
  • 4-Chloro-7-methoxy-2-(phenyl)quinoline

Work with 4-Chloro-7-methoxy-2-phenylquinoline

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-7-methoxyquinoline68500-37-853 % similar 2,4-Dichloro-7-methoxyquinazoline62484-31-550 % similar 3-Methoxybiphenyl2113-56-645 % similar 6,9-Dichloro-2-methoxyacridine86-38-445 % similar 2,3-Dichloro-6-methoxyquinoxaline39267-04-444 % similar 4-Chloro-7-methoxyquinazoline55496-52-143 % similar 2-(4-Methoxyphenyl)quinoline-4-carboxylic acid4364-02-743 % similar 6,7-Dimethoxy-3-phenylquinoxaline146535-11-743 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

7-(Benzyloxy)-4-chloroquinoline178984-56-0

Elsewhere

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