2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole;2-(3,5-dimethoxyphenyl)-4-(4-fluorophenyl)-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,3-thiazole;4-(2,4-dimethoxyphenyl)-2-pyridin-3-yl-1,3-thiazole;4-[2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-yl]phenol;4-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]phenol;2-(3,5-dimethoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,3-thiazole;4-[2-(4-hydroxyphenyl)-1,3-thiazol-4-yl]benzonitrile;2-[4-(4-phenyl-1,3-thiazol-2-yl)phenoxy]acetonitrile;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)benzonitrile;4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenol;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenol

C216H172F8N20O25S13 — CID 159796291

IUPAC2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole;2-(3,5-dimethoxyphenyl)-4-(4-fluorophenyl)-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,3-thiazole;4-(2,4-dimethoxyphenyl)-2-pyridin-3-yl-1,3-thiazole;4-[2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-yl]phenol;4-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]phenol;2-(3,5-dimethoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,3-thiazole;4-[2-(4-hydroxyphenyl)-1,3-thiazol-4-yl]benzonitrile;2-[4-(4-phenyl-1,3-thiazol-2-yl)phenoxy]acetonitrile;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)benzonitrile;4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenol;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenol
SMILESCOc1cc(OC)cc(-c2nc(-c3ccc(F)cc3)cs2)c1.COc1cc(OC)cc(-c2nc(-c3cccc(C(F)(F)F)c3)cs2)c1.COc1ccc(-c2csc(-c3ccc(O)cc3)n2)c(OC)c1.COc1ccc(-c2csc(-c3ccc(OC)cc3OC)n2)c(OC)c1.COc1ccc(-c2csc(-c3ccc(OC)cc3OC)n2)cc1.COc1ccc(-c2csc(-c3cccnc3)n2)c(OC)c1.COc1ccc(-c2nc(-c3ccc(F)c(C(F)(F)F)c3)cs2)c(OC)c1.COc1ccc(-c2nc(-c3ccc(O)cc3)cs2)c(OC)c1.N#CCOc1ccc(-c2nc(-c3ccccc3)cs2)cc1.N#Cc1ccc(-c2csc(-c3ccc(O)cc3)n2)cc1.N#Cc1ccc(-c2csc(-c3cccnc3)n2)cc1.Oc1ccc(-c2csc(-c3ccccn3)n2)cc1.Oc1ccc(-c2csc(-c3cccnc3)n2)cc1
InChIInChI=1S/C19H19NO4S.C18H13F4NO2S.C18H14F3NO2S.C18H17NO3S.C17H14FNO2S.C17H12N2OS.2C17H15NO3S.C16H14N2O2S.C16H10N2OS.C15H9N3S.2C14H10N2OS/c1-21-12-5-7-14(17(9-12)23-3)16-11-25-19(20-16)15-8-6-13(22-2)10-18(15)24-4;1-24-11-4-5-12(16(8-11)25-2)17-23-15(9-26-17)10-3-6-14(19)13(7-10)18(20,21)22;1-23-14-7-12(8-15(9-14)24-2)17-22-16(10-25-17)11-4-3-5-13(6-11)18(19,20)21;1-20-13-6-4-12(5-7-13)16-11-23-18(19-16)15-9-8-14(21-2)10-17(15)22-3;1-20-14-7-12(8-15(9-14)21-2)17-19-16(10-22-17)11-3-5-13(18)6-4-11;18-10-11-20-15-8-6-14(7-9-15)17-19-16(12-21-17)13-4-2-1-3-5-13;1-20-13-7-8-14(16(9-13)21-2)15-10-22-17(18-15)11-3-5-12(19)6-4-11;1-20-13-7-8-14(16(9-13)21-2)17-18-15(10-22-17)11-3-5-12(19)6-4-11;1-19-12-5-6-13(15(8-12)20-2)14-10-21-16(18-14)11-4-3-7-17-9-11;17-9-11-1-3-12(4-2-11)15-10-20-16(18-15)13-5-7-14(19)8-6-13;16-8-11-3-5-12(6-4-11)14-10-19-15(18-14)13-2-1-7-17-9-13;17-12-5-3-10(4-6-12)13-9-18-14(16-13)11-2-1-7-15-8-11;17-11-6-4-10(5-7-11)13-9-18-14(16-13)12-3-1-2-8-15-12/h5-11H,1-4H3;3-9H,1-2H3;3-10H,1-2H3;4-11H,1-3H3;3-10H,1-2H3;1-9,12H,11H2;2*3-10,19H,1-2H3;3-10H,1-2H3;1-8,10,19H;1-7,9-10H;2*1-9,17H
InChIKeyNJFHAJHYUSKIRU-UHFFFAOYSA-N
MW4016.72 g/mol
LogP56.44
Rot. Bonds47

About 2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole;2-(3,5-dimethoxyphenyl)-4-(4-fluorophenyl)-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,3-thiazole;4-(2,4-dimethoxyphenyl)-2-pyridin-3-yl-1,3-thiazole;4-[2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-yl]phenol;4-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]phenol;2-(3,5-dimethoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,3-thiazole;4-[2-(4-hydroxyphenyl)-1,3-thiazol-4-yl]benzonitrile;2-[4-(4-phenyl-1,3-thiazol-2-yl)phenoxy]acetonitrile;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)benzonitrile;4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenol;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenol

2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole;2-(3,5-dimethoxyphenyl)-4-(4-fluorophenyl)-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,3-thiazole;4-(2,4-dimethoxyphenyl)-2-pyridin-3-yl-1,3-thiazole;4-[2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-yl]phenol;4-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]phenol;2-(3,5-dimethoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,3-thiazole;4-[2-(4-hydroxyphenyl)-1,3-thiazol-4-yl]benzonitrile;2-[4-(4-phenyl-1,3-thiazol-2-yl)phenoxy]acetonitrile;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)benzonitrile;4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenol;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenol (PubChem CID 159796291) has the molecular formula C216H172F8N20O25S13 and a molecular weight of 4016.72 g/mol. Its IUPAC name is 2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole;2-(3,5-dimethoxyphenyl)-4-(4-fluorophenyl)-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,3-thiazole;4-(2,4-dimethoxyphenyl)-2-pyridin-3-yl-1,3-thiazole;4-[2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-yl]phenol;4-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]phenol;2-(3,5-dimethoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,3-thiazole;4-[2-(4-hydroxyphenyl)-1,3-thiazol-4-yl]benzonitrile;2-[4-(4-phenyl-1,3-thiazol-2-yl)phenoxy]acetonitrile;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)benzonitrile;4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenol;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenol.

Molecular Properties

Compound Name2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole;2-(3,5-dimethoxyphenyl)-4-(4-fluorophenyl)-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,3-thiazole;4-(2,4-dimethoxyphenyl)-2-pyridin-3-yl-1,3-thiazole;4-[2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-yl]phenol;4-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]phenol;2-(3,5-dimethoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,3-thiazole;4-[2-(4-hydroxyphenyl)-1,3-thiazol-4-yl]benzonitrile;2-[4-(4-phenyl-1,3-thiazol-2-yl)phenoxy]acetonitrile;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)benzonitrile;4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenol;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenol
PubChem CID159796291
Molecular FormulaC216H172F8N20O25S13
Molecular Weight4016.72 g/mol
Exact Mass4012.90
IUPAC Name2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole;2-(3,5-dimethoxyphenyl)-4-(4-fluorophenyl)-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,3-thiazole;4-(2,4-dimethoxyphenyl)-2-pyridin-3-yl-1,3-thiazole;4-[2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-yl]phenol;4-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]phenol;2-(3,5-dimethoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,3-thiazole;4-[2-(4-hydroxyphenyl)-1,3-thiazol-4-yl]benzonitrile;2-[4-(4-phenyl-1,3-thiazol-2-yl)phenoxy]acetonitrile;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)benzonitrile;4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenol;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenol
SMILESCOc1cc(OC)cc(-c2nc(-c3ccc(F)cc3)cs2)c1.COc1cc(OC)cc(-c2nc(-c3cccc(C(F)(F)F)c3)cs2)c1.COc1ccc(-c2csc(-c3ccc(O)cc3)n2)c(OC)c1.COc1ccc(-c2csc(-c3ccc(OC)cc3OC)n2)c(OC)c1.COc1ccc(-c2csc(-c3ccc(OC)cc3OC)n2)cc1.COc1ccc(-c2csc(-c3cccnc3)n2)c(OC)c1.COc1ccc(-c2nc(-c3ccc(F)c(C(F)(F)F)c3)cs2)c(OC)c1.COc1ccc(-c2nc(-c3ccc(O)cc3)cs2)c(OC)c1.N#CCOc1ccc(-c2nc(-c3ccccc3)cs2)cc1.N#Cc1ccc(-c2csc(-c3ccc(O)cc3)n2)cc1.N#Cc1ccc(-c2csc(-c3cccnc3)n2)cc1.Oc1ccc(-c2csc(-c3ccccn3)n2)cc1.Oc1ccc(-c2csc(-c3cccnc3)n2)cc1
InChIInChI=1S/C19H19NO4S.C18H13F4NO2S.C18H14F3NO2S.C18H17NO3S.C17H14FNO2S.C17H12N2OS.2C17H15NO3S.C16H14N2O2S.C16H10N2OS.C15H9N3S.2C14H10N2OS/c1-21-12-5-7-14(17(9-12)23-3)16-11-25-19(20-16)15-8-6-13(22-2)10-18(15)24-4;1-24-11-4-5-12(16(8-11)25-2)17-23-15(9-26-17)10-3-6-14(19)13(7-10)18(20,21)22;1-23-14-7-12(8-15(9-14)24-2)17-22-16(10-25-17)11-4-3-5-13(6-11)18(19,20)21;1-20-13-6-4-12(5-7-13)16-11-23-18(19-16)15-9-8-14(21-2)10-17(15)22-3;1-20-14-7-12(8-15(9-14)21-2)17-19-16(10-22-17)11-3-5-13(18)6-4-11;18-10-11-20-15-8-6-14(7-9-15)17-19-16(12-21-17)13-4-2-1-3-5-13;1-20-13-7-8-14(16(9-13)21-2)15-10-22-17(18-15)11-3-5-12(19)6-4-11;1-20-13-7-8-14(16(9-13)21-2)17-18-15(10-22-17)11-3-5-12(19)6-4-11;1-19-12-5-6-13(15(8-12)20-2)14-10-21-16(18-14)11-4-3-7-17-9-11;17-9-11-1-3-12(4-2-11)15-10-20-16(18-15)13-5-7-14(19)8-6-13;16-8-11-3-5-12(6-4-11)14-10-19-15(18-14)13-2-1-7-17-9-13;17-12-5-3-10(4-6-12)13-9-18-14(16-13)11-2-1-7-15-8-11;17-11-6-4-10(5-7-11)13-9-18-14(16-13)12-3-1-2-8-15-12/h5-11H,1-4H3;3-9H,1-2H3;3-10H,1-2H3;4-11H,1-3H3;3-10H,1-2H3;1-9,12H,11H2;2*3-10,19H,1-2H3;3-10H,1-2H3;1-8,10,19H;1-7,9-10H;2*1-9,17H
InChIKeyNJFHAJHYUSKIRU-UHFFFAOYSA-N
XLogP56.44
TPSA576.25 Ų
H-Bond Donors5
H-Bond Acceptors58
Rotatable Bonds47
Heavy Atoms282
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004016.72
LogP ≤ 556.44
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1058

Analyze 2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole;2-(3,5-dimethoxyphenyl)-4-(4-fluorophenyl)-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,3-thiazole;4-(2,4-dimethoxyphenyl)-2-pyridin-3-yl-1,3-thiazole;4-[2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-yl]phenol;4-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]phenol;2-(3,5-dimethoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,3-thiazole;4-[2-(4-hydroxyphenyl)-1,3-thiazol-4-yl]benzonitrile;2-[4-(4-phenyl-1,3-thiazol-2-yl)phenoxy]acetonitrile;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)benzonitrile;4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenol;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenol with MolForge

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Related Compounds

4-[2-[4-(cyanomethoxy)phenyl]-1,3-thiazol-4-yl]benzonitrile;2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]pyrazine;4-[2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-yl]benzonitrile;2,4-dimethyl-1-[(E)-2-phenylethenyl]benzene;4-[(E)-2-(2,4-dimethylphenyl)ethenyl]-1-methylpyrimidin-1-ium;2-[(E)-2-(2,4-dimethylphenyl)ethenyl]pyrazine;3-[(E)-2-(2,4-dimethylphenyl)ethenyl]pyridine;4-[(E)-2-(2,4-dimethylphenyl)ethenyl]pyrimidine;5-[(E)-2-(2,4-dimethylphenyl)ethenyl]pyrimidine;4-[4-fluoro-3-(trifluoromethyl)phenyl]-2-pyridin-2-yl-1,3-thiazole;4-[4-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]phenol;4-[(E)-2-(4-methoxy-2,6-dimethylphenyl)ethenyl]pyrimidine;4-[(E)-2-(3-methoxy-5-methylphenyl)ethenyl]pyrimidine;bis(4-[(E)-2-(4-prop-2-ynoxyphenyl)ethenyl]pyrimidine);4-[2-(4-prop-2-ynoxyphenyl)-1,3-thiazol-4-yl]benzonitrile;4-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]pyrimidine;iodide
CID 161366346
4-[2-[6-(3,4-Difluorophenyl)-3-pyridinyl]ethynyl]-2-methyl-1,3-thiazole;4-fluoro-3-[5-[2-(2-methyl-1,3-thiazol-4-yl)ethynyl]-2-pyridinyl]benzonitrile;4-[2-[6-(4-fluorophenyl)-3-pyridinyl]ethynyl]-2-methyl-1,3-thiazole;4-[2-[6-(2-methoxy-5-methylphenyl)-3-pyridinyl]ethynyl]-2-methyl-1,3-thiazole;[2-[5-[2-(2-methyl-1,3-thiazol-4-yl)ethynyl]-2-pyridinyl]phenyl]methanol
CID 157050906

Frequently Asked Questions

What is the IUPAC name of 2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole;2-(3,5-dimethoxyphenyl)-4-(4-fluorophenyl)-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,3-thiazole;4-(2,4-dimethoxyphenyl)-2-pyridin-3-yl-1,3-thiazole;4-[2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-yl]phenol;4-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]phenol;2-(3,5-dimethoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,3-thiazole;4-[2-(4-hydroxyphenyl)-1,3-thiazol-4-yl]benzonitrile;2-[4-(4-phenyl-1,3-thiazol-2-yl)phenoxy]acetonitrile;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)benzonitrile;4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenol;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenol?
The IUPAC name of 2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole;2-(3,5-dimethoxyphenyl)-4-(4-fluorophenyl)-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,3-thiazole;4-(2,4-dimethoxyphenyl)-2-pyridin-3-yl-1,3-thiazole;4-[2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-yl]phenol;4-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]phenol;2-(3,5-dimethoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,3-thiazole;4-[2-(4-hydroxyphenyl)-1,3-thiazol-4-yl]benzonitrile;2-[4-(4-phenyl-1,3-thiazol-2-yl)phenoxy]acetonitrile;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)benzonitrile;4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenol;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenol (CID 159796291) is 2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole;2-(3,5-dimethoxyphenyl)-4-(4-fluorophenyl)-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,3-thiazole;4-(2,4-dimethoxyphenyl)-2-pyridin-3-yl-1,3-thiazole;4-[2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-yl]phenol;4-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]phenol;2-(3,5-dimethoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,3-thiazole;4-[2-(4-hydroxyphenyl)-1,3-thiazol-4-yl]benzonitrile;2-[4-(4-phenyl-1,3-thiazol-2-yl)phenoxy]acetonitrile;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)benzonitrile;4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenol;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenol.
What is the SMILES notation for 2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole;2-(3,5-dimethoxyphenyl)-4-(4-fluorophenyl)-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,3-thiazole;4-(2,4-dimethoxyphenyl)-2-pyridin-3-yl-1,3-thiazole;4-[2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-yl]phenol;4-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]phenol;2-(3,5-dimethoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,3-thiazole;4-[2-(4-hydroxyphenyl)-1,3-thiazol-4-yl]benzonitrile;2-[4-(4-phenyl-1,3-thiazol-2-yl)phenoxy]acetonitrile;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)benzonitrile;4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenol;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenol?
The canonical SMILES for 2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole;2-(3,5-dimethoxyphenyl)-4-(4-fluorophenyl)-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,3-thiazole;4-(2,4-dimethoxyphenyl)-2-pyridin-3-yl-1,3-thiazole;4-[2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-yl]phenol;4-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]phenol;2-(3,5-dimethoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,3-thiazole;4-[2-(4-hydroxyphenyl)-1,3-thiazol-4-yl]benzonitrile;2-[4-(4-phenyl-1,3-thiazol-2-yl)phenoxy]acetonitrile;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)benzonitrile;4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenol;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenol is COc1cc(OC)cc(-c2nc(-c3ccc(F)cc3)cs2)c1.COc1cc(OC)cc(-c2nc(-c3cccc(C(F)(F)F)c3)cs2)c1.COc1ccc(-c2csc(-c3ccc(O)cc3)n2)c(OC)c1.COc1ccc(-c2csc(-c3ccc(OC)cc3OC)n2)c(OC)c1.COc1ccc(-c2csc(-c3ccc(OC)cc3OC)n2)cc1.COc1ccc(-c2csc(-c3cccnc3)n2)c(OC)c1.COc1ccc(-c2nc(-c3ccc(F)c(C(F)(F)F)c3)cs2)c(OC)c1.COc1ccc(-c2nc(-c3ccc(O)cc3)cs2)c(OC)c1.N#CCOc1ccc(-c2nc(-c3ccccc3)cs2)cc1.N#Cc1ccc(-c2csc(-c3ccc(O)cc3)n2)cc1.N#Cc1ccc(-c2csc(-c3cccnc3)n2)cc1.Oc1ccc(-c2csc(-c3ccccn3)n2)cc1.Oc1ccc(-c2csc(-c3cccnc3)n2)cc1.
What is the InChIKey of 2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole;2-(3,5-dimethoxyphenyl)-4-(4-fluorophenyl)-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,3-thiazole;4-(2,4-dimethoxyphenyl)-2-pyridin-3-yl-1,3-thiazole;4-[2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-yl]phenol;4-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]phenol;2-(3,5-dimethoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,3-thiazole;4-[2-(4-hydroxyphenyl)-1,3-thiazol-4-yl]benzonitrile;2-[4-(4-phenyl-1,3-thiazol-2-yl)phenoxy]acetonitrile;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)benzonitrile;4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenol;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenol?
The InChIKey is NJFHAJHYUSKIRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO4S.C18H13F4NO2S.C18H14F3NO2S.C18H17NO3S.C17H14FNO2S.C17H12N2OS.2C17H15NO3S.C16H14N2O2S.C16H10N2OS.C15H9N3S.2C14H10N2OS/c1-21-12-5-7-14(17(9-12)23-3)16-11-25-19(20-16)15-8-6-13(22-2)10-18(15)24-4;1-24-11-4-5-12(16(8-11)25-2)17-23-15(9-26-17)10-3-6-14(19)13(7-10)18(20,21)22;1-23-14-7-12(8-15(9-14)24-2)17-22-16(10-25-17)11-4-3-5-13(6-11)18(19,20)21;1-20-13-6-4-12(5-7-13)16-11-23-18(19-16)15-9-8-14(21-2)10-17(15)22-3;1-20-14-7-12(8-15(9-14)21-2)17-19-16(10-22-17)11-3-5-13(18)6-4-11;18-10-11-20-15-8-6-14(7-9-15)17-19-16(12-21-17)13-4-2-1-3-5-13;1-20-13-7-8-14(16(9-13)21-2)15-10-22-17(18-15)11-3-5-12(19)6-4-11;1-20-13-7-8-14(16(9-13)21-2)17-18-15(10-22-17)11-3-5-12(19)6-4-11;1-19-12-5-6-13(15(8-12)20-2)14-10-21-16(18-14)11-4-3-7-17-9-11;17-9-11-1-3-12(4-2-11)15-10-20-16(18-15)13-5-7-14(19)8-6-13;16-8-11-3-5-12(6-4-11)14-10-19-15(18-14)13-2-1-7-17-9-13;17-12-5-3-10(4-6-12)13-9-18-14(16-13)11-2-1-7-15-8-11;17-11-6-4-10(5-7-11)13-9-18-14(16-13)12-3-1-2-8-15-12/h5-11H,1-4H3;3-9H,1-2H3;3-10H,1-2H3;4-11H,1-3H3;3-10H,1-2H3;1-9,12H,11H2;2*3-10,19H,1-2H3;3-10H,1-2H3;1-8,10,19H;1-7,9-10H;2*1-9,17H.
What are the key properties of 2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole;2-(3,5-dimethoxyphenyl)-4-(4-fluorophenyl)-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,3-thiazole;4-(2,4-dimethoxyphenyl)-2-pyridin-3-yl-1,3-thiazole;4-[2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-yl]phenol;4-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]phenol;2-(3,5-dimethoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,3-thiazole;4-[2-(4-hydroxyphenyl)-1,3-thiazol-4-yl]benzonitrile;2-[4-(4-phenyl-1,3-thiazol-2-yl)phenoxy]acetonitrile;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)benzonitrile;4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenol;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenol?
2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole;2-(3,5-dimethoxyphenyl)-4-(4-fluorophenyl)-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,3-thiazole;4-(2,4-dimethoxyphenyl)-2-pyridin-3-yl-1,3-thiazole;4-[2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-yl]phenol;4-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]phenol;2-(3,5-dimethoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,3-thiazole;4-[2-(4-hydroxyphenyl)-1,3-thiazol-4-yl]benzonitrile;2-[4-(4-phenyl-1,3-thiazol-2-yl)phenoxy]acetonitrile;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)benzonitrile;4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenol;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenol has a molecular weight of 4016.72 g/mol, XLogP of 56.44, 47 rotatable bonds, 5 hydrogen bond donors, and 58 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole;2-(3,5-dimethoxyphenyl)-4-(4-fluorophenyl)-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole;2-(2,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,3-thiazole;4-(2,4-dimethoxyphenyl)-2-pyridin-3-yl-1,3-thiazole;4-[2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-yl]phenol;4-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]phenol;2-(3,5-dimethoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,3-thiazole;4-[2-(4-hydroxyphenyl)-1,3-thiazol-4-yl]benzonitrile;2-[4-(4-phenyl-1,3-thiazol-2-yl)phenoxy]acetonitrile;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)benzonitrile;4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenol;4-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenol is sourced from PubChem (CID 159796291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).