5-[2-(N-carbamoyl-4-hexoxyanilino)-1,3-thiazol-4-yl]-2-hydroxybenzamide;1-[4-(cyclohexylmethoxy)-3-fluorophenyl]-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(3-fluoro-4-pentoxyphenyl)urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-(3-fluoro-4-pentoxyphenyl)-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-heptoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-methoxy-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-octoxyphenyl)urea;1-(4-methylphenyl)-3-phenyl-1-(4-phenyl-1,3-thiazol-2-yl)urea

C220H223F16N31O21S10 — CID 158622368

IUPAC5-[2-(N-carbamoyl-4-hexoxyanilino)-1,3-thiazol-4-yl]-2-hydroxybenzamide;1-[4-(cyclohexylmethoxy)-3-fluorophenyl]-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(3-fluoro-4-pentoxyphenyl)urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-(3-fluoro-4-pentoxyphenyl)-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-heptoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-methoxy-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-octoxyphenyl)urea;1-(4-methylphenyl)-3-phenyl-1-(4-phenyl-1,3-thiazol-2-yl)urea
SMILESCCCCCCCCOc1ccc(N(C(N)=O)c2nc(-c3ccc(F)cc3)cs2)cc1.CCCCCCCOc1ccc(N(C(N)=O)c2nc(-c3ccc(F)cc3)cs2)cc1.CCCCCCOc1ccc(N(C(N)=O)c2nc(-c3ccc(F)c(F)c3)cs2)cc1.CCCCCCOc1ccc(N(C(N)=O)c2nc(-c3ccc(F)cc3)cs2)cc1.CCCCCCOc1ccc(N(C(N)=O)c2nc(-c3ccc(O)c(C(N)=O)c3)cs2)cc1.CCCCCOc1ccc(N(C(N)=O)c2nc(-c3ccc(F)c(F)c3)cs2)cc1F.CCCCCOc1ccc(N(C(N)=O)c2nc(-c3ccc(F)cc3)cs2)cc1F.COc1ccc(N(C(N)=O)c2nc(-c3ccc(F)cc3)cs2)cc1C(F)(F)F.Cc1ccc(N(C(=O)Nc2ccccc2)c2nc(-c3ccccc3)cs2)cc1.NC(=O)N(c1ccc(OCC2CCCCC2)c(F)c1)c1nc(-c2ccc(F)cc2)cs1
InChIInChI=1S/C24H28FN3O2S.C23H23F2N3O2S.C23H26FN3O2S.C23H26N4O4S.C23H19N3OS.C22H23F2N3O2S.C22H24FN3O2S.C21H20F3N3O2S.C21H21F2N3O2S.C18H13F4N3O2S/c1-2-3-4-5-6-7-16-30-21-14-12-20(13-15-21)28(23(26)29)24-27-22(17-31-24)18-8-10-19(25)11-9-18;24-17-8-6-16(7-9-17)20-14-31-23(27-20)28(22(26)29)18-10-11-21(19(25)12-18)30-13-15-4-2-1-3-5-15;1-2-3-4-5-6-15-29-20-13-11-19(12-14-20)27(22(25)28)23-26-21(16-30-23)17-7-9-18(24)10-8-17;1-2-3-4-5-12-31-17-9-7-16(8-10-17)27(22(25)30)23-26-19(14-32-23)15-6-11-20(28)18(13-15)21(24)29;1-17-12-14-20(15-13-17)26(22(27)24-19-10-6-3-7-11-19)23-25-21(16-28-23)18-8-4-2-5-9-18;1-2-3-4-5-12-29-17-9-7-16(8-10-17)27(21(25)28)22-26-20(14-30-22)15-6-11-18(23)19(24)13-15;1-2-3-4-5-14-28-19-12-10-18(11-13-19)26(21(24)27)22-25-20(15-29-22)16-6-8-17(23)9-7-16;1-2-3-4-9-29-19-8-6-14(11-17(19)24)27(20(25)28)21-26-18(12-30-21)13-5-7-15(22)16(23)10-13;1-2-3-4-11-28-19-10-9-16(12-17(19)23)26(20(24)27)21-25-18(13-29-21)14-5-7-15(22)8-6-14;1-27-15-7-6-12(8-13(15)18(20,21)22)25(16(23)26)17-24-14(9-28-17)10-2-4-11(19)5-3-10/h8-15,17H,2-7,16H2,1H3,(H2,26,29);6-12,14-15H,1-5,13H2,(H2,26,29);7-14,16H,2-6,15H2,1H3,(H2,25,28);6-11,13-14,28H,2-5,12H2,1H3,(H2,24,29)(H2,25,30);2-16H,1H3,(H,24,27);6-11,13-14H,2-5,12H2,1H3,(H2,25,28);6-13,15H,2-5,14H2,1H3,(H2,24,27);5-8,10-12H,2-4,9H2,1H3,(H2,25,28);5-10,12-13H,2-4,11H2,1H3,(H2,24,27);2-9H,1H3,(H2,23,26)
InChIKeyHYDWVWRPSKPONW-UHFFFAOYSA-N
MW4262.04 g/mol
LogP60.43
Rot. Bonds79

About 5-[2-(N-carbamoyl-4-hexoxyanilino)-1,3-thiazol-4-yl]-2-hydroxybenzamide;1-[4-(cyclohexylmethoxy)-3-fluorophenyl]-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(3-fluoro-4-pentoxyphenyl)urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-(3-fluoro-4-pentoxyphenyl)-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-heptoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-methoxy-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-octoxyphenyl)urea;1-(4-methylphenyl)-3-phenyl-1-(4-phenyl-1,3-thiazol-2-yl)urea

5-[2-(N-carbamoyl-4-hexoxyanilino)-1,3-thiazol-4-yl]-2-hydroxybenzamide;1-[4-(cyclohexylmethoxy)-3-fluorophenyl]-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(3-fluoro-4-pentoxyphenyl)urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-(3-fluoro-4-pentoxyphenyl)-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-heptoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-methoxy-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-octoxyphenyl)urea;1-(4-methylphenyl)-3-phenyl-1-(4-phenyl-1,3-thiazol-2-yl)urea (PubChem CID 158622368) has the molecular formula C220H223F16N31O21S10 and a molecular weight of 4262.04 g/mol. Its IUPAC name is 5-[2-(N-carbamoyl-4-hexoxyanilino)-1,3-thiazol-4-yl]-2-hydroxybenzamide;1-[4-(cyclohexylmethoxy)-3-fluorophenyl]-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(3-fluoro-4-pentoxyphenyl)urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-(3-fluoro-4-pentoxyphenyl)-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-heptoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-methoxy-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-octoxyphenyl)urea;1-(4-methylphenyl)-3-phenyl-1-(4-phenyl-1,3-thiazol-2-yl)urea.

Molecular Properties

Compound Name5-[2-(N-carbamoyl-4-hexoxyanilino)-1,3-thiazol-4-yl]-2-hydroxybenzamide;1-[4-(cyclohexylmethoxy)-3-fluorophenyl]-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(3-fluoro-4-pentoxyphenyl)urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-(3-fluoro-4-pentoxyphenyl)-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-heptoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-methoxy-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-octoxyphenyl)urea;1-(4-methylphenyl)-3-phenyl-1-(4-phenyl-1,3-thiazol-2-yl)urea
PubChem CID158622368
Molecular FormulaC220H223F16N31O21S10
Molecular Weight4262.04 g/mol
Exact Mass4258.43
IUPAC Name5-[2-(N-carbamoyl-4-hexoxyanilino)-1,3-thiazol-4-yl]-2-hydroxybenzamide;1-[4-(cyclohexylmethoxy)-3-fluorophenyl]-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(3-fluoro-4-pentoxyphenyl)urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-(3-fluoro-4-pentoxyphenyl)-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-heptoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-methoxy-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-octoxyphenyl)urea;1-(4-methylphenyl)-3-phenyl-1-(4-phenyl-1,3-thiazol-2-yl)urea
SMILESCCCCCCCCOc1ccc(N(C(N)=O)c2nc(-c3ccc(F)cc3)cs2)cc1.CCCCCCCOc1ccc(N(C(N)=O)c2nc(-c3ccc(F)cc3)cs2)cc1.CCCCCCOc1ccc(N(C(N)=O)c2nc(-c3ccc(F)c(F)c3)cs2)cc1.CCCCCCOc1ccc(N(C(N)=O)c2nc(-c3ccc(F)cc3)cs2)cc1.CCCCCCOc1ccc(N(C(N)=O)c2nc(-c3ccc(O)c(C(N)=O)c3)cs2)cc1.CCCCCOc1ccc(N(C(N)=O)c2nc(-c3ccc(F)c(F)c3)cs2)cc1F.CCCCCOc1ccc(N(C(N)=O)c2nc(-c3ccc(F)cc3)cs2)cc1F.COc1ccc(N(C(N)=O)c2nc(-c3ccc(F)cc3)cs2)cc1C(F)(F)F.Cc1ccc(N(C(=O)Nc2ccccc2)c2nc(-c3ccccc3)cs2)cc1.NC(=O)N(c1ccc(OCC2CCCCC2)c(F)c1)c1nc(-c2ccc(F)cc2)cs1
InChIInChI=1S/C24H28FN3O2S.C23H23F2N3O2S.C23H26FN3O2S.C23H26N4O4S.C23H19N3OS.C22H23F2N3O2S.C22H24FN3O2S.C21H20F3N3O2S.C21H21F2N3O2S.C18H13F4N3O2S/c1-2-3-4-5-6-7-16-30-21-14-12-20(13-15-21)28(23(26)29)24-27-22(17-31-24)18-8-10-19(25)11-9-18;24-17-8-6-16(7-9-17)20-14-31-23(27-20)28(22(26)29)18-10-11-21(19(25)12-18)30-13-15-4-2-1-3-5-15;1-2-3-4-5-6-15-29-20-13-11-19(12-14-20)27(22(25)28)23-26-21(16-30-23)17-7-9-18(24)10-8-17;1-2-3-4-5-12-31-17-9-7-16(8-10-17)27(22(25)30)23-26-19(14-32-23)15-6-11-20(28)18(13-15)21(24)29;1-17-12-14-20(15-13-17)26(22(27)24-19-10-6-3-7-11-19)23-25-21(16-28-23)18-8-4-2-5-9-18;1-2-3-4-5-12-29-17-9-7-16(8-10-17)27(21(25)28)22-26-20(14-30-22)15-6-11-18(23)19(24)13-15;1-2-3-4-5-14-28-19-12-10-18(11-13-19)26(21(24)27)22-25-20(15-29-22)16-6-8-17(23)9-7-16;1-2-3-4-9-29-19-8-6-14(11-17(19)24)27(20(25)28)21-26-18(12-30-21)13-5-7-15(22)16(23)10-13;1-2-3-4-11-28-19-10-9-16(12-17(19)23)26(20(24)27)21-25-18(13-29-21)14-5-7-15(22)8-6-14;1-27-15-7-6-12(8-13(15)18(20,21)22)25(16(23)26)17-24-14(9-28-17)10-2-4-11(19)5-3-10/h8-15,17H,2-7,16H2,1H3,(H2,26,29);6-12,14-15H,1-5,13H2,(H2,26,29);7-14,16H,2-6,15H2,1H3,(H2,25,28);6-11,13-14,28H,2-5,12H2,1H3,(H2,24,29)(H2,25,30);2-16H,1H3,(H,24,27);6-11,13-14H,2-5,12H2,1H3,(H2,25,28);6-13,15H,2-5,14H2,1H3,(H2,24,27);5-8,10-12H,2-4,9H2,1H3,(H2,25,28);5-10,12-13H,2-4,11H2,1H3,(H2,24,27);2-9H,1H3,(H2,23,26)
InChIKeyHYDWVWRPSKPONW-UHFFFAOYSA-N
XLogP60.43
TPSA724.60 Ų
H-Bond Donors12
H-Bond Acceptors41
Rotatable Bonds79
Heavy Atoms298
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004262.04
LogP ≤ 560.43
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1041

Analyze 5-[2-(N-carbamoyl-4-hexoxyanilino)-1,3-thiazol-4-yl]-2-hydroxybenzamide;1-[4-(cyclohexylmethoxy)-3-fluorophenyl]-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(3-fluoro-4-pentoxyphenyl)urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-(3-fluoro-4-pentoxyphenyl)-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-heptoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-methoxy-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-octoxyphenyl)urea;1-(4-methylphenyl)-3-phenyl-1-(4-phenyl-1,3-thiazol-2-yl)urea with MolForge

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Related Compounds

5-[2-[N-carbamoyl-4-(cyclohexylmethoxy)-3-fluoro-anilino]thiazol-4-yl]-2-hydroxy-benzamide
CID 58966332
5-[2-[4-butoxy-N-carbamoyl-3-(trifluoromethyl)anilino]thiazol-4-yl]-2-hydroxy-benzamide
CID 58966336
5-[2-[N-carbamoyl-4-isobutoxy-3-(trifluoromethyl)anilino]thiazol-4-yl]-2-hydroxy-benzamide
CID 58966367
5-[2-[4-butoxy-N-carbamoyl-3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]-2-hydroxybenzamide;5-[2-[N-carbamoyl-4-(cyclohexylmethoxy)-3-fluoroanilino]-1,3-thiazol-4-yl]-2-hydroxybenzamide;5-[2-[N-carbamoyl-4-[methyl(pentyl)amino]-3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]-2-hydroxybenzamide;5-[2-[N-carbamoyl-4-(2-methylpropoxy)-3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]-2-hydroxybenzamide;1-[4-(cyclohexylmethoxy)-3-fluorophenyl]-1-[4-(3-oxo-4H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-[4-[methyl(pentyl)amino]-3-(trifluoromethyl)phenyl]urea;1-(3-fluoro-4-pentoxyphenyl)-1-[4-(3-oxo-4H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]urea;1-(4-hexoxyphenyl)-1-[4-(3-oxo-4H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]urea
CID 157549957
1-[4-butoxy-3-(trifluoromethyl)phenyl]-1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-butoxy-3-(trifluoromethyl)phenyl]-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;5-[2-(N-carbamoyl-3-fluoro-4-pentoxyanilino)-1,3-thiazol-4-yl]-2-hydroxybenzamide;1-[4-(cyclohexylmethoxy)-3-fluorophenyl]-1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-[4-(2-methylpropoxy)-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-[methyl(pentyl)amino]-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-(2-methylpropoxy)-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-pentoxy-3-(trifluoromethyl)phenyl]urea
CID 159594351
5-[2-[4-butoxy-N-carbamoyl-3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]-2-hydroxybenzamide;5-[2-[N-carbamoyl-4-(cyclohexylmethoxy)-3-fluoroanilino]-1,3-thiazol-4-yl]-2-hydroxybenzamide;5-[2-[N-carbamoyl-4-[methyl(pentyl)amino]-3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]-2-hydroxybenzamide;5-[2-[N-carbamoyl-4-(2-methylpropoxy)-3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]-2-hydroxybenzamide;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-[4-[methyl(pentyl)amino]-3-(trifluoromethyl)phenyl]urea;1-(3-fluoro-4-pentoxyphenyl)-1-[4-(3-oxo-4H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]urea;1-(4-hexoxyphenyl)-1-[4-(3-oxo-4H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]urea
CID 159725694
1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-heptoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-phenylurea;1-(4-methylphenyl)-3-phenyl-1-(4-phenyl-1,3-thiazol-2-yl)urea;3-nitro-5-(trifluoromethyl)-N-[3-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]phenyl]benzamide;4-phenyl-3-prop-2-enyl-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-3-ium
CID 160405882
5-[2-(N-carbamoyl-4-hexoxyanilino)-1,3-thiazol-4-yl]-2-hydroxybenzamide;1-[4-(cyclohexylmethoxy)-3-fluorophenyl]-1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(cyclohexylmethoxy)-3-fluorophenyl]-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(3-fluoro-4-pentoxyphenyl)urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-(3-fluoro-4-pentoxyphenyl)-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-methoxy-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-octoxyphenyl)urea
CID 160575941
1-[4-butoxy-3-(trifluoromethyl)phenyl]-1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-butoxy-3-(trifluoromethyl)phenyl]-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;5-[2-(N-carbamoyl-3-fluoro-4-pentoxyanilino)-1,3-thiazol-4-yl]-2-hydroxybenzamide;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-[4-(2-methylpropoxy)-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-[methyl(pentyl)amino]-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-(2-methylpropoxy)-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-pentoxy-3-(trifluoromethyl)phenyl]urea
CID 162207612
5-[2-[N-carbamoyl-4-(cyclohexylmethoxy)-3-fluoroanilino]-1,3-thiazol-4-yl]-N-[6-[2-(N-carbamoyl-4-hexoxyanilino)-1,3-thiazol-4-yl]-3-oxo-4H-1,4-benzoxazin-7-yl]-2-hydroxybenzamide
CID 166675990

Frequently Asked Questions

What is the IUPAC name of 5-[2-(N-carbamoyl-4-hexoxyanilino)-1,3-thiazol-4-yl]-2-hydroxybenzamide;1-[4-(cyclohexylmethoxy)-3-fluorophenyl]-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(3-fluoro-4-pentoxyphenyl)urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-(3-fluoro-4-pentoxyphenyl)-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-heptoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-methoxy-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-octoxyphenyl)urea;1-(4-methylphenyl)-3-phenyl-1-(4-phenyl-1,3-thiazol-2-yl)urea?
The IUPAC name of 5-[2-(N-carbamoyl-4-hexoxyanilino)-1,3-thiazol-4-yl]-2-hydroxybenzamide;1-[4-(cyclohexylmethoxy)-3-fluorophenyl]-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(3-fluoro-4-pentoxyphenyl)urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-(3-fluoro-4-pentoxyphenyl)-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-heptoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-methoxy-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-octoxyphenyl)urea;1-(4-methylphenyl)-3-phenyl-1-(4-phenyl-1,3-thiazol-2-yl)urea (CID 158622368) is 5-[2-(N-carbamoyl-4-hexoxyanilino)-1,3-thiazol-4-yl]-2-hydroxybenzamide;1-[4-(cyclohexylmethoxy)-3-fluorophenyl]-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(3-fluoro-4-pentoxyphenyl)urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-(3-fluoro-4-pentoxyphenyl)-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-heptoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-methoxy-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-octoxyphenyl)urea;1-(4-methylphenyl)-3-phenyl-1-(4-phenyl-1,3-thiazol-2-yl)urea.
What is the SMILES notation for 5-[2-(N-carbamoyl-4-hexoxyanilino)-1,3-thiazol-4-yl]-2-hydroxybenzamide;1-[4-(cyclohexylmethoxy)-3-fluorophenyl]-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(3-fluoro-4-pentoxyphenyl)urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-(3-fluoro-4-pentoxyphenyl)-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-heptoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-methoxy-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-octoxyphenyl)urea;1-(4-methylphenyl)-3-phenyl-1-(4-phenyl-1,3-thiazol-2-yl)urea?
The canonical SMILES for 5-[2-(N-carbamoyl-4-hexoxyanilino)-1,3-thiazol-4-yl]-2-hydroxybenzamide;1-[4-(cyclohexylmethoxy)-3-fluorophenyl]-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(3-fluoro-4-pentoxyphenyl)urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-(3-fluoro-4-pentoxyphenyl)-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-heptoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-methoxy-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-octoxyphenyl)urea;1-(4-methylphenyl)-3-phenyl-1-(4-phenyl-1,3-thiazol-2-yl)urea is CCCCCCCCOc1ccc(N(C(N)=O)c2nc(-c3ccc(F)cc3)cs2)cc1.CCCCCCCOc1ccc(N(C(N)=O)c2nc(-c3ccc(F)cc3)cs2)cc1.CCCCCCOc1ccc(N(C(N)=O)c2nc(-c3ccc(F)c(F)c3)cs2)cc1.CCCCCCOc1ccc(N(C(N)=O)c2nc(-c3ccc(F)cc3)cs2)cc1.CCCCCCOc1ccc(N(C(N)=O)c2nc(-c3ccc(O)c(C(N)=O)c3)cs2)cc1.CCCCCOc1ccc(N(C(N)=O)c2nc(-c3ccc(F)c(F)c3)cs2)cc1F.CCCCCOc1ccc(N(C(N)=O)c2nc(-c3ccc(F)cc3)cs2)cc1F.COc1ccc(N(C(N)=O)c2nc(-c3ccc(F)cc3)cs2)cc1C(F)(F)F.Cc1ccc(N(C(=O)Nc2ccccc2)c2nc(-c3ccccc3)cs2)cc1.NC(=O)N(c1ccc(OCC2CCCCC2)c(F)c1)c1nc(-c2ccc(F)cc2)cs1.
What is the InChIKey of 5-[2-(N-carbamoyl-4-hexoxyanilino)-1,3-thiazol-4-yl]-2-hydroxybenzamide;1-[4-(cyclohexylmethoxy)-3-fluorophenyl]-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(3-fluoro-4-pentoxyphenyl)urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-(3-fluoro-4-pentoxyphenyl)-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-heptoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-methoxy-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-octoxyphenyl)urea;1-(4-methylphenyl)-3-phenyl-1-(4-phenyl-1,3-thiazol-2-yl)urea?
The InChIKey is HYDWVWRPSKPONW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28FN3O2S.C23H23F2N3O2S.C23H26FN3O2S.C23H26N4O4S.C23H19N3OS.C22H23F2N3O2S.C22H24FN3O2S.C21H20F3N3O2S.C21H21F2N3O2S.C18H13F4N3O2S/c1-2-3-4-5-6-7-16-30-21-14-12-20(13-15-21)28(23(26)29)24-27-22(17-31-24)18-8-10-19(25)11-9-18;24-17-8-6-16(7-9-17)20-14-31-23(27-20)28(22(26)29)18-10-11-21(19(25)12-18)30-13-15-4-2-1-3-5-15;1-2-3-4-5-6-15-29-20-13-11-19(12-14-20)27(22(25)28)23-26-21(16-30-23)17-7-9-18(24)10-8-17;1-2-3-4-5-12-31-17-9-7-16(8-10-17)27(22(25)30)23-26-19(14-32-23)15-6-11-20(28)18(13-15)21(24)29;1-17-12-14-20(15-13-17)26(22(27)24-19-10-6-3-7-11-19)23-25-21(16-28-23)18-8-4-2-5-9-18;1-2-3-4-5-12-29-17-9-7-16(8-10-17)27(21(25)28)22-26-20(14-30-22)15-6-11-18(23)19(24)13-15;1-2-3-4-5-14-28-19-12-10-18(11-13-19)26(21(24)27)22-25-20(15-29-22)16-6-8-17(23)9-7-16;1-2-3-4-9-29-19-8-6-14(11-17(19)24)27(20(25)28)21-26-18(12-30-21)13-5-7-15(22)16(23)10-13;1-2-3-4-11-28-19-10-9-16(12-17(19)23)26(20(24)27)21-25-18(13-29-21)14-5-7-15(22)8-6-14;1-27-15-7-6-12(8-13(15)18(20,21)22)25(16(23)26)17-24-14(9-28-17)10-2-4-11(19)5-3-10/h8-15,17H,2-7,16H2,1H3,(H2,26,29);6-12,14-15H,1-5,13H2,(H2,26,29);7-14,16H,2-6,15H2,1H3,(H2,25,28);6-11,13-14,28H,2-5,12H2,1H3,(H2,24,29)(H2,25,30);2-16H,1H3,(H,24,27);6-11,13-14H,2-5,12H2,1H3,(H2,25,28);6-13,15H,2-5,14H2,1H3,(H2,24,27);5-8,10-12H,2-4,9H2,1H3,(H2,25,28);5-10,12-13H,2-4,11H2,1H3,(H2,24,27);2-9H,1H3,(H2,23,26).
What are the key properties of 5-[2-(N-carbamoyl-4-hexoxyanilino)-1,3-thiazol-4-yl]-2-hydroxybenzamide;1-[4-(cyclohexylmethoxy)-3-fluorophenyl]-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(3-fluoro-4-pentoxyphenyl)urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-(3-fluoro-4-pentoxyphenyl)-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-heptoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-methoxy-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-octoxyphenyl)urea;1-(4-methylphenyl)-3-phenyl-1-(4-phenyl-1,3-thiazol-2-yl)urea?
5-[2-(N-carbamoyl-4-hexoxyanilino)-1,3-thiazol-4-yl]-2-hydroxybenzamide;1-[4-(cyclohexylmethoxy)-3-fluorophenyl]-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(3-fluoro-4-pentoxyphenyl)urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-(3-fluoro-4-pentoxyphenyl)-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-heptoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-methoxy-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-octoxyphenyl)urea;1-(4-methylphenyl)-3-phenyl-1-(4-phenyl-1,3-thiazol-2-yl)urea has a molecular weight of 4262.04 g/mol, XLogP of 60.43, 79 rotatable bonds, 12 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(N-carbamoyl-4-hexoxyanilino)-1,3-thiazol-4-yl]-2-hydroxybenzamide;1-[4-(cyclohexylmethoxy)-3-fluorophenyl]-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(3-fluoro-4-pentoxyphenyl)urea;1-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-(3-fluoro-4-pentoxyphenyl)-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-heptoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-hexoxyphenyl)urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-[4-methoxy-3-(trifluoromethyl)phenyl]urea;1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-octoxyphenyl)urea;1-(4-methylphenyl)-3-phenyl-1-(4-phenyl-1,3-thiazol-2-yl)urea is sourced from PubChem (CID 158622368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).