4-(2-chlorophenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;4-(2-fluorophenyl)-5-(4H-imidazol-5-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-5-yl)-4-(2-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(oxan-4-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-4-[2-(trifluoromethyl)phenyl]-1,3-thiazole

C98H75ClF4N28O2S5 — CID 159308894

IUPAC4-(2-chlorophenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;4-(2-fluorophenyl)-5-(4H-imidazol-5-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-5-yl)-4-(2-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(oxan-4-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-4-[2-(trifluoromethyl)phenyl]-1,3-thiazole
SMILESCOc1ccccc1-c1nc(-c2c(C)nn3ccccc23)sc1C1=NC=NC1.Cc1nn2ccccc2c1-c1nc(-c2ccccc2C(F)(F)F)c(-c2ncn[nH]2)s1.Cc1nn2ccccc2c1-c1nc(-c2ccccc2Cl)c(-c2ncn[nH]2)s1.Cc1nn2ccccc2c1-c1nc(-c2ccccc2F)c(C2=NC=NC2)s1.Cc1nn2ccccc2c1-c1nc(C2CCOCC2)c(-c2ncn[nH]2)s1
InChIInChI=1S/C21H17N5OS.C20H13F3N6S.C20H14FN5S.C19H13ClN6S.C18H18N6OS/c1-13-18(16-8-5-6-10-26(16)25-13)21-24-19(14-7-3-4-9-17(14)27-2)20(28-21)15-11-22-12-23-15;1-11-15(14-8-4-5-9-29(14)28-11)19-26-16(17(30-19)18-24-10-25-27-18)12-6-2-3-7-13(12)20(21,22)23;1-12-17(16-8-4-5-9-26(16)25-12)20-24-18(13-6-2-3-7-14(13)21)19(27-20)15-10-22-11-23-15;1-11-15(14-8-4-5-9-26(14)25-11)19-23-16(12-6-2-3-7-13(12)20)17(27-19)18-21-10-22-24-18;1-11-14(13-4-2-3-7-24(13)23-11)18-21-15(12-5-8-25-9-6-12)16(26-18)17-19-10-20-22-17/h3-10,12H,11H2,1-2H3;2-10H,1H3,(H,24,25,27);2-9,11H,10H2,1H3;2-10H,1H3,(H,21,22,24);2-4,7,10,12H,5-6,8-9H2,1H3,(H,19,20,22)
InChIKeyLCGXWSOSZORXNQ-UHFFFAOYSA-N
MW1948.65 g/mol
LogP22.23
Rot. Bonds16

About 4-(2-chlorophenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;4-(2-fluorophenyl)-5-(4H-imidazol-5-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-5-yl)-4-(2-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(oxan-4-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-4-[2-(trifluoromethyl)phenyl]-1,3-thiazole

4-(2-chlorophenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;4-(2-fluorophenyl)-5-(4H-imidazol-5-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-5-yl)-4-(2-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(oxan-4-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-4-[2-(trifluoromethyl)phenyl]-1,3-thiazole (PubChem CID 159308894) has the molecular formula C98H75ClF4N28O2S5 and a molecular weight of 1948.65 g/mol. Its IUPAC name is 4-(2-chlorophenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;4-(2-fluorophenyl)-5-(4H-imidazol-5-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-5-yl)-4-(2-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(oxan-4-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-4-[2-(trifluoromethyl)phenyl]-1,3-thiazole.

Molecular Properties

Compound Name4-(2-chlorophenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;4-(2-fluorophenyl)-5-(4H-imidazol-5-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-5-yl)-4-(2-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(oxan-4-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-4-[2-(trifluoromethyl)phenyl]-1,3-thiazole
PubChem CID159308894
Molecular FormulaC98H75ClF4N28O2S5
Molecular Weight1948.65 g/mol
Exact Mass1946.49
IUPAC Name4-(2-chlorophenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;4-(2-fluorophenyl)-5-(4H-imidazol-5-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-5-yl)-4-(2-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(oxan-4-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-4-[2-(trifluoromethyl)phenyl]-1,3-thiazole
SMILESCOc1ccccc1-c1nc(-c2c(C)nn3ccccc23)sc1C1=NC=NC1.Cc1nn2ccccc2c1-c1nc(-c2ccccc2C(F)(F)F)c(-c2ncn[nH]2)s1.Cc1nn2ccccc2c1-c1nc(-c2ccccc2Cl)c(-c2ncn[nH]2)s1.Cc1nn2ccccc2c1-c1nc(-c2ccccc2F)c(C2=NC=NC2)s1.Cc1nn2ccccc2c1-c1nc(C2CCOCC2)c(-c2ncn[nH]2)s1
InChIInChI=1S/C21H17N5OS.C20H13F3N6S.C20H14FN5S.C19H13ClN6S.C18H18N6OS/c1-13-18(16-8-5-6-10-26(16)25-13)21-24-19(14-7-3-4-9-17(14)27-2)20(28-21)15-11-22-12-23-15;1-11-15(14-8-4-5-9-29(14)28-11)19-26-16(17(30-19)18-24-10-25-27-18)12-6-2-3-7-13(12)20(21,22)23;1-12-17(16-8-4-5-9-26(16)25-12)20-24-18(13-6-2-3-7-14(13)21)19(27-20)15-10-22-11-23-15;1-11-15(14-8-4-5-9-26(14)25-11)19-23-16(12-6-2-3-7-13(12)20)17(27-19)18-21-10-22-24-18;1-11-14(13-4-2-3-7-24(13)23-11)18-21-15(12-5-8-25-9-6-12)16(26-18)17-19-10-20-22-17/h3-10,12H,11H2,1-2H3;2-10H,1H3,(H,24,25,27);2-9,11H,10H2,1H3;2-10H,1H3,(H,21,22,24);2-4,7,10,12H,5-6,8-9H2,1H3,(H,19,20,22)
InChIKeyLCGXWSOSZORXNQ-UHFFFAOYSA-N
XLogP22.23
TPSA343.56 Ų
H-Bond Donors3
H-Bond Acceptors32
Rotatable Bonds16
Heavy Atoms138
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001948.65
LogP ≤ 522.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1032

Analyze 4-(2-chlorophenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;4-(2-fluorophenyl)-5-(4H-imidazol-5-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-5-yl)-4-(2-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(oxan-4-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-4-[2-(trifluoromethyl)phenyl]-1,3-thiazole with MolForge

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Related Compounds

CID 157335544
CID 157335544
3-(2-chloro-3-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-chloro-3-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridine;3-(2,4-difluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-fluoro-2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(2-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridine;4-(5-methylthiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine;[2-(3-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]methanol;4-[3-(4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridin-3-yl)-2-pyridinyl]morpholine
CID 157676385
1-[2-tert-butyl-3-(2-chlorophenyl)-2-(2,4-difluorophenyl)but-3-enyl]-1,2,4-triazole;1-[2-(2,4-difluorophenyl)-3,3-dimethyl-2-[(1S)-1-[4-(2-methylpyrazol-3-yl)phenyl]ethyl]butyl]-1,2,4-triazole;1-[2-(2,4-difluorophenyl)-3,3-dimethyl-2-(pyrazol-1-ylmethyl)butyl]-1,2,4-triazole;1-[2-(2,4-difluorophenyl)-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)butyl]-3-[(E)-2-[4-(2,2,3-trifluorobutoxy)phenyl]ethenyl]-1,2,4-triazole;2-[(2R)-3-(2,4-difluorophenyl)-4,4-dimethyl-3-(1,2,4-triazol-1-ylmethyl)pentan-2-yl]-3-fluoropyridine;2-[(2R)-3-(2,4-difluorophenyl)-4,4-dimethyl-3-(1,2,4-triazol-1-ylmethyl)pentan-2-yl]-4-(4-methylphenyl)-1,3-thiazole;methane
CID 157726571
7-(2,4-Difluorophenyl)-8-(2,6-dimethyl-4-pyridinyl)-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-(2,4-difluorophenyl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(2,6-dimethyl-4-pyridinyl)-2-methyl-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-(4-fluoro-2-methoxyphenyl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;2-methyl-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-(1-methylpyrazol-3-yl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-7-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine
CID 158035203
3-(2-chloro-3-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(3-chlorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2,4-difluorophenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;3-(2-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-[3-[4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-yl]-2-pyridinyl]morpholine;4-(5-methylthiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine
CID 158661799
3-(2-chloro-3-fluorophenyl)-4-(5-chlorothiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-fluorophenyl)-4-(5-chlorothiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-chlorothiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(3-chlorophenyl)-4-(5-chlorothiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-ethoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(4-fluoro-2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-fluorophenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(4-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;4-[3-[4-(5-chlorothiophen-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-yl]-2-pyridinyl]morpholine;4-(5-chlorothiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine
CID 158666103
4-(2-chlorophenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1-methyl-1,2,4-triazol-3-yl)-1,3-thiazole;4-(2-fluorophenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(3H-pyrrol-2-yl)-1,3-thiazole;4-(2-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(3H-pyrrol-2-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1-methyl-1,2,4-triazol-3-yl)-4-(oxan-4-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-4-[2-(trifluoromethyl)phenyl]-1,3-thiazole
CID 158936950
3-(2-chloro-3-fluorophenyl)-4-(5-chlorothiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-fluorophenyl)-4-(5-chlorothiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-chlorothiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(3-chlorophenyl)-4-(5-chlorothiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-ethoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(4-fluoro-2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-fluorophenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(4-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine
CID 159047700
1-[(4-Chlorophenyl)methyl]-3,5-dimethylpyrazole;2-(2,3-dihydro-1-benzofuran-5-yl)-4-methyl-1,3-thiazole;4,5-dimethyl-1-phenylpyrazole;3,5-dimethyl-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazole;2-(4-fluorophenoxy)-3-methylpyridine;1-(4-fluorophenyl)-4,5-dimethylpyrazole;1-(4-fluorophenyl)-4-methyl-5-(trifluoromethyl)pyrazole;1-(4-methoxyphenyl)-4,5-dimethylpyrazole;3-methyl-2-phenoxypyridine;5-methyl-2-phenoxypyridine;3-methyl-5-phenylpyridine;4-methyl-1-phenyl-5-(trifluoromethyl)pyrazole
CID 159581830
4-[[2-[(4-azidophenyl)methyl]-5-[3,5-bis(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-6-chloro-2-methylsulfanylpyrimidine;4-[[5-[3,5-bis(trifluoromethyl)phenyl]-2-[(3-methoxy-5-methylphenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-6-chloro-2-methylsulfanylpyrimidine;4-[[5-[3,5-bis(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-6-chloro-2-[(5-methyl-2-pyridinyl)sulfanyl]pyrimidine;2-[4-[[5-[3,5-bis(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-6-chloropyrimidin-2-yl]sulfanyl-4-phenyl-1,3-thiazole
CID 159670888
CID 160274858
CID 160274858
3-(3-chlorophenyl)-4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridine;4-[3-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-2H-pyrazolo[3,4-b]pyridin-4-yl]-2-methyl-1,3-thiazole;3-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridine;4-[2-methoxy-5-[4-(2-methyl-1,3-thiazol-4-yl)-2H-pyrazolo[3,4-b]pyridin-3-yl]phenyl]morpholine;4-[3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-4-yl]-2-methyl-1,3-thiazole;4-[2-methoxy-5-(4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridin-3-yl)phenyl]morpholine;3-[5-(4-methylpiperazin-1-yl)-2-(trifluoromethoxy)phenyl]-4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridine;4-[3-(4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridin-3-yl)-4-(trifluoromethoxy)phenyl]morpholine
CID 160431571

Frequently Asked Questions

What is the IUPAC name of 4-(2-chlorophenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;4-(2-fluorophenyl)-5-(4H-imidazol-5-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-5-yl)-4-(2-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(oxan-4-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-4-[2-(trifluoromethyl)phenyl]-1,3-thiazole?
The IUPAC name of 4-(2-chlorophenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;4-(2-fluorophenyl)-5-(4H-imidazol-5-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-5-yl)-4-(2-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(oxan-4-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-4-[2-(trifluoromethyl)phenyl]-1,3-thiazole (CID 159308894) is 4-(2-chlorophenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;4-(2-fluorophenyl)-5-(4H-imidazol-5-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-5-yl)-4-(2-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(oxan-4-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-4-[2-(trifluoromethyl)phenyl]-1,3-thiazole.
What is the SMILES notation for 4-(2-chlorophenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;4-(2-fluorophenyl)-5-(4H-imidazol-5-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-5-yl)-4-(2-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(oxan-4-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-4-[2-(trifluoromethyl)phenyl]-1,3-thiazole?
The canonical SMILES for 4-(2-chlorophenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;4-(2-fluorophenyl)-5-(4H-imidazol-5-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-5-yl)-4-(2-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(oxan-4-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-4-[2-(trifluoromethyl)phenyl]-1,3-thiazole is COc1ccccc1-c1nc(-c2c(C)nn3ccccc23)sc1C1=NC=NC1.Cc1nn2ccccc2c1-c1nc(-c2ccccc2C(F)(F)F)c(-c2ncn[nH]2)s1.Cc1nn2ccccc2c1-c1nc(-c2ccccc2Cl)c(-c2ncn[nH]2)s1.Cc1nn2ccccc2c1-c1nc(-c2ccccc2F)c(C2=NC=NC2)s1.Cc1nn2ccccc2c1-c1nc(C2CCOCC2)c(-c2ncn[nH]2)s1.
What is the InChIKey of 4-(2-chlorophenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;4-(2-fluorophenyl)-5-(4H-imidazol-5-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-5-yl)-4-(2-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(oxan-4-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-4-[2-(trifluoromethyl)phenyl]-1,3-thiazole?
The InChIKey is LCGXWSOSZORXNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N5OS.C20H13F3N6S.C20H14FN5S.C19H13ClN6S.C18H18N6OS/c1-13-18(16-8-5-6-10-26(16)25-13)21-24-19(14-7-3-4-9-17(14)27-2)20(28-21)15-11-22-12-23-15;1-11-15(14-8-4-5-9-29(14)28-11)19-26-16(17(30-19)18-24-10-25-27-18)12-6-2-3-7-13(12)20(21,22)23;1-12-17(16-8-4-5-9-26(16)25-12)20-24-18(13-6-2-3-7-14(13)21)19(27-20)15-10-22-11-23-15;1-11-15(14-8-4-5-9-26(14)25-11)19-23-16(12-6-2-3-7-13(12)20)17(27-19)18-21-10-22-24-18;1-11-14(13-4-2-3-7-24(13)23-11)18-21-15(12-5-8-25-9-6-12)16(26-18)17-19-10-20-22-17/h3-10,12H,11H2,1-2H3;2-10H,1H3,(H,24,25,27);2-9,11H,10H2,1H3;2-10H,1H3,(H,21,22,24);2-4,7,10,12H,5-6,8-9H2,1H3,(H,19,20,22).
What are the key properties of 4-(2-chlorophenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;4-(2-fluorophenyl)-5-(4H-imidazol-5-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-5-yl)-4-(2-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(oxan-4-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-4-[2-(trifluoromethyl)phenyl]-1,3-thiazole?
4-(2-chlorophenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;4-(2-fluorophenyl)-5-(4H-imidazol-5-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-5-yl)-4-(2-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(oxan-4-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-4-[2-(trifluoromethyl)phenyl]-1,3-thiazole has a molecular weight of 1948.65 g/mol, XLogP of 22.23, 16 rotatable bonds, 3 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-chlorophenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;4-(2-fluorophenyl)-5-(4H-imidazol-5-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-5-yl)-4-(2-methoxyphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(oxan-4-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-4-[2-(trifluoromethyl)phenyl]-1,3-thiazole is sourced from PubChem (CID 159308894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).