6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(2,4-difluoro-3-methylphenyl)-3-pyridinyl]-1,3-benzothiazole;4-[3-(6-methyl-2-pyridinyl)-2-pyridinyl]quinoline

C75H50Cl2F5N13S — CID 158123856

IUPAC6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(2,4-difluoro-3-methylphenyl)-3-pyridinyl]-1,3-benzothiazole;4-[3-(6-methyl-2-pyridinyl)-2-pyridinyl]quinoline
SMILESCc1c(F)ccc(-c2ncccc2-c2ccc3ncsc3c2)c1F.Cc1cc2ncnn2cc1-c1cccnc1-c1cc(Cl)c(F)cc1F.Cc1cc2ncnn2cc1-c1cccnc1-c1cc(Cl)ccc1F.Cc1cccc(-c2cccnc2-c2ccnc3ccccc23)n1
InChIInChI=1S/C20H15N3.C19H12F2N2S.C18H11ClF2N4.C18H12ClFN4/c1-14-6-4-10-19(23-14)17-8-5-12-22-20(17)16-11-13-21-18-9-3-2-7-15(16)18;1-11-15(20)6-5-14(18(11)21)19-13(3-2-8-22-19)12-4-7-16-17(9-12)24-10-23-16;1-10-5-17-23-9-24-25(17)8-13(10)11-3-2-4-22-18(11)12-6-14(19)16(21)7-15(12)20;1-11-7-17-22-10-23-24(17)9-15(11)13-3-2-6-21-18(13)14-8-12(19)4-5-16(14)20/h2-13H,1H3;2-10H,1H3;2-9H,1H3;2-10H,1H3
InChIKeyFRXPTABXAGEECR-UHFFFAOYSA-N
MW1331.28 g/mol
LogP19.54
Rot. Bonds8

About 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(2,4-difluoro-3-methylphenyl)-3-pyridinyl]-1,3-benzothiazole;4-[3-(6-methyl-2-pyridinyl)-2-pyridinyl]quinoline

6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(2,4-difluoro-3-methylphenyl)-3-pyridinyl]-1,3-benzothiazole;4-[3-(6-methyl-2-pyridinyl)-2-pyridinyl]quinoline (PubChem CID 158123856) has the molecular formula C75H50Cl2F5N13S and a molecular weight of 1331.28 g/mol. Its IUPAC name is 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(2,4-difluoro-3-methylphenyl)-3-pyridinyl]-1,3-benzothiazole;4-[3-(6-methyl-2-pyridinyl)-2-pyridinyl]quinoline.

Molecular Properties

Compound Name6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(2,4-difluoro-3-methylphenyl)-3-pyridinyl]-1,3-benzothiazole;4-[3-(6-methyl-2-pyridinyl)-2-pyridinyl]quinoline
PubChem CID158123856
Molecular FormulaC75H50Cl2F5N13S
Molecular Weight1331.28 g/mol
Exact Mass1329.33
IUPAC Name6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(2,4-difluoro-3-methylphenyl)-3-pyridinyl]-1,3-benzothiazole;4-[3-(6-methyl-2-pyridinyl)-2-pyridinyl]quinoline
SMILESCc1c(F)ccc(-c2ncccc2-c2ccc3ncsc3c2)c1F.Cc1cc2ncnn2cc1-c1cccnc1-c1cc(Cl)c(F)cc1F.Cc1cc2ncnn2cc1-c1cccnc1-c1cc(Cl)ccc1F.Cc1cccc(-c2cccnc2-c2ccnc3ccccc23)n1
InChIInChI=1S/C20H15N3.C19H12F2N2S.C18H11ClF2N4.C18H12ClFN4/c1-14-6-4-10-19(23-14)17-8-5-12-22-20(17)16-11-13-21-18-9-3-2-7-15(16)18;1-11-15(20)6-5-14(18(11)21)19-13(3-2-8-22-19)12-4-7-16-17(9-12)24-10-23-16;1-10-5-17-23-9-24-25(17)8-13(10)11-3-2-4-22-18(11)12-6-14(19)16(21)7-15(12)20;1-11-7-17-22-10-23-24(17)9-15(11)13-3-2-6-21-18(13)14-8-12(19)4-5-16(14)20/h2-13H,1H3;2-10H,1H3;2-9H,1H3;2-10H,1H3
InChIKeyFRXPTABXAGEECR-UHFFFAOYSA-N
XLogP19.54
TPSA150.61 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds8
Heavy Atoms96
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001331.28
LogP ≤ 519.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

Analyze 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(2,4-difluoro-3-methylphenyl)-3-pyridinyl]-1,3-benzothiazole;4-[3-(6-methyl-2-pyridinyl)-2-pyridinyl]quinoline with MolForge

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Related Compounds

6-(1,3-benzothiazol-6-yl)-N-[[2-chloro-6-fluoro-4-[4-(3-methylphenyl)-6-[1-[3-(1-methylpyrazol-4-yl)phenyl]ethylamino]pyrimidin-2-yl]phenyl]methyl]-2-methylpyrimidin-4-amine
CID 123543683
6-[5-[3-chloro-4-[3-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-yl]phenyl]-2-[2-chloro-4-[3-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-(2,4,5-trifluorophenyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-5-yl]phenyl]-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]-1,3-benzothiazole
CID 145164714
6-[1-[[6-[5-Amino-3-[3-(trifluoromethyl)pyrazol-1-yl]pyrazin-2-yl]-8-chloroquinolin-3-yl]methyl]pyrazol-3-yl]-5-(4-chloro-1,3-benzothiazol-6-yl)pyrazin-2-amine
CID 156450002
7-[2-(5-Chloro-2,4-difluorophenyl)-5-methyl-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(3-chloro-4-fluorophenyl)-5-methyl-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(5-chloro-2-fluorophenyl)-5-methyl-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(3-chlorophenyl)-5-methyl-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1,3-benzothiazole;7-[5-methyl-2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 159479024
8-chloro-6-methylimidazo[1,2-a]pyridine;7-chloro-5-methyl-1H-indazole;8-chloro-6-methylquinoline;3,5-dimethyl-2H-indazole;6,8-dimethylquinoline;2,4-dimethyl-6-(trifluoromethyl)pyridine;6-methyl-1,3-benzothiazole;6-methylcinnoline;6-methylimidazo[1,2-a]pyridine;5-methyl-1H-indazole;6-methylisoquinoline;6-methylquinolin-2-amine;bis(6-methylquinoline);6-methylquinoxaline;6-methyl-1,2,3,4-tetrahydroquinoline;6-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-methyl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine;tris(2,4,6-trimethylpyridine)
CID 161014562
7-[2-(5-Chloro-2,4-difluorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]pyrido[2,3-b]pyrazine;7-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(3-chlorophenyl)-3-pyridinyl]pyrido[2,3-b]pyrazine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]pyrido[2,3-b]pyrazine;7-[2-(2-fluoro-5-methylphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 157143183
7-(8-Ethyl-2-methylimidazo[1,2-b]pyridazin-6-yl)-3-(1-ethylpiperidin-4-yl)-5-fluorocinnoline;6-[3-(1-ethylpiperidin-4-yl)-5-fluorocinnolin-7-yl]-2,4-dimethyl-1,3-benzothiazole
CID 157211646
6-(1,3-benzothiazol-6-yl)-5-fluoro-N-[[5-fluoro-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyrimidin-4-amine;6-(1,3-benzothiazol-6-yl)-5-fluoro-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyrimidin-4-amine;5-fluoro-N-[[5-fluoro-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-6-naphthalen-2-ylpyrimidin-4-amine;5-fluoro-N-[[5-fluoro-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-6-quinolin-6-ylpyrimidin-4-amine;5-fluoro-N-[[4-(2-methyl-4-pyridinyl)phenyl]methyl]-6-([1,2,4]triazolo[1,5-a]pyridin-6-yl)pyrimidin-4-amine;5-fluoro-N-[[5-(2-methyl-4-pyridinyl)-2-pyridinyl]methyl]-6-naphthalen-2-ylpyrimidin-4-amine;5-fluoro-6-naphthalen-2-yl-N-[(4-pyridin-4-ylphenyl)methyl]pyrimidin-4-amine
CID 157230514
6-[2-(3-Chloro-4-fluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;2-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-1,5-naphthyridine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]quinoxaline;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(2,4,5-trifluorophenyl)-3-pyridinyl]-1,3-benzothiazole
CID 157810204
6-[2-(3-Chloro-4-fluorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(3-chlorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;3-isocyano-6-[2-(2,4,5-trifluorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(2,4,5-trifluorophenyl)-3-pyridinyl]-1,3-benzothiazole;6-[2-(2,4,5-trifluorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(2,4,5-trifluorophenyl)-3-pyridinyl]quinoline
CID 157905176
6-[2-(3-Chloro-4-fluorophenyl)-3-pyridinyl]-1,3-benzothiazole;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]quinoline;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]quinoxaline
CID 157912555
9-tert-butylacridine;6-tert-butyl-4-chloro-1,3-benzothiazole;6-tert-butyl-4-chloro-1H-isoindole;6-tert-butyl-4-chloro-2-methylidene-1,3-dihydroindene;5-tert-butyl-4,6-di(propan-2-yl)pyrimidine;5-tert-butyl-3H-indazole;4-tert-butyl-3-methylquinoline;5-tert-butylpyrazolo[1,5-a]pyridine;9-tert-butyl-1,2,3,4-tetrahydroacridine;1-(2,2-dimethylpropyl)-3,5-difluorobenzene
CID 158156334

Frequently Asked Questions

What is the IUPAC name of 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(2,4-difluoro-3-methylphenyl)-3-pyridinyl]-1,3-benzothiazole;4-[3-(6-methyl-2-pyridinyl)-2-pyridinyl]quinoline?
The IUPAC name of 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(2,4-difluoro-3-methylphenyl)-3-pyridinyl]-1,3-benzothiazole;4-[3-(6-methyl-2-pyridinyl)-2-pyridinyl]quinoline (CID 158123856) is 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(2,4-difluoro-3-methylphenyl)-3-pyridinyl]-1,3-benzothiazole;4-[3-(6-methyl-2-pyridinyl)-2-pyridinyl]quinoline.
What is the SMILES notation for 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(2,4-difluoro-3-methylphenyl)-3-pyridinyl]-1,3-benzothiazole;4-[3-(6-methyl-2-pyridinyl)-2-pyridinyl]quinoline?
The canonical SMILES for 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(2,4-difluoro-3-methylphenyl)-3-pyridinyl]-1,3-benzothiazole;4-[3-(6-methyl-2-pyridinyl)-2-pyridinyl]quinoline is Cc1c(F)ccc(-c2ncccc2-c2ccc3ncsc3c2)c1F.Cc1cc2ncnn2cc1-c1cccnc1-c1cc(Cl)c(F)cc1F.Cc1cc2ncnn2cc1-c1cccnc1-c1cc(Cl)ccc1F.Cc1cccc(-c2cccnc2-c2ccnc3ccccc23)n1.
What is the InChIKey of 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(2,4-difluoro-3-methylphenyl)-3-pyridinyl]-1,3-benzothiazole;4-[3-(6-methyl-2-pyridinyl)-2-pyridinyl]quinoline?
The InChIKey is FRXPTABXAGEECR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3.C19H12F2N2S.C18H11ClF2N4.C18H12ClFN4/c1-14-6-4-10-19(23-14)17-8-5-12-22-20(17)16-11-13-21-18-9-3-2-7-15(16)18;1-11-15(20)6-5-14(18(11)21)19-13(3-2-8-22-19)12-4-7-16-17(9-12)24-10-23-16;1-10-5-17-23-9-24-25(17)8-13(10)11-3-2-4-22-18(11)12-6-14(19)16(21)7-15(12)20;1-11-7-17-22-10-23-24(17)9-15(11)13-3-2-6-21-18(13)14-8-12(19)4-5-16(14)20/h2-13H,1H3;2-10H,1H3;2-9H,1H3;2-10H,1H3.
What are the key properties of 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(2,4-difluoro-3-methylphenyl)-3-pyridinyl]-1,3-benzothiazole;4-[3-(6-methyl-2-pyridinyl)-2-pyridinyl]quinoline?
6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(2,4-difluoro-3-methylphenyl)-3-pyridinyl]-1,3-benzothiazole;4-[3-(6-methyl-2-pyridinyl)-2-pyridinyl]quinoline has a molecular weight of 1331.28 g/mol, XLogP of 19.54, 8 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-[2-(2,4-difluoro-3-methylphenyl)-3-pyridinyl]-1,3-benzothiazole;4-[3-(6-methyl-2-pyridinyl)-2-pyridinyl]quinoline is sourced from PubChem (CID 158123856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).