N-(5-tert-butyl-6-chloropyridazin-3-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-(4-tert-butyl-5-chloropyrimidin-2-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;2-[(2S)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[3-chloro-4-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;3-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;2-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;3-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;(3R)-1-(5-chloro-6-methoxypyrimidin-4-yl)-3-[3-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-5-yl]butan-1-one;(3R)-1-[5-chloro-6-(pyridin-4-ylamino)pyrimidin-4-yl]-3-[5-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-3-yl]butan-1-one

C226H183Cl18F27N52O34S7 — CID 158729117

IUPACN-(5-tert-butyl-6-chloropyridazin-3-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-(4-tert-butyl-5-chloropyrimidin-2-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;2-[(2S)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[3-chloro-4-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;3-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;2-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;3-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;(3R)-1-(5-chloro-6-methoxypyrimidin-4-yl)-3-[3-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-5-yl]butan-1-one;(3R)-1-[5-chloro-6-(pyridin-4-ylamino)pyrimidin-4-yl]-3-[5-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-3-yl]butan-1-one
SMILESCOc1ncnc(C(=O)CC(C)c2ncc(C(=O)Nc3cc(C(C)(C)C)c(Cl)nn3)s2)c1Cl.COc1ncnc(C(=O)CC(C)c2ncc(C(=O)Nc3cc(C(F)(F)F)c(Cl)cn3)s2)c1Cl.COc1ncnc(C(=O)CC(C)c2ncc(C(=O)Nc3ccc(C(F)(F)F)c(Cl)c3)s2)c1Cl.COc1ncnc(C(=O)CC(C)c2ncc(C(=O)Nc3ncc(Cl)c(C(C)(C)C)n3)s2)c1Cl.COc1ncnc(C(=O)CCc2cc(C(=O)Nc3ccc(C)c(C(F)(F)F)c3)on2)c1Cl.COc1ncnc(C(=O)CCc2ncc(C(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)s2)c1Cl.COc1ncnc(C(=O)C[C@@H](C)c2cc(C(=O)Nc3ccc(C)c(C(F)(F)F)c3)on2)c1Cl.COc1ncnc(C(=O)C[C@@H](C)c2cc(C3=Nc4ccc(C(F)(F)F)cc4C3)no2)c1Cl.COc1ncnc(C(=O)C[C@@H](C)c2ncc(C(=O)Nc3cc(C(F)(F)F)c(Cl)cn3)s2)c1Cl.COc1ncnc(C(=O)C[C@H](C)c2ncc(C(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)s2)c1Cl.C[C@H](CC(=O)c1ncnc(Nc2ccncc2)c1Cl)c1cc(C2=Nc3ccc(C(F)(F)F)cc3C2)on1
InChIInChI=1S/C25H18ClF3N6O2.2C21H22Cl2N6O3S.C21H18ClF3N4O4.C21H16ClF3N4O3.2C20H15Cl2F3N4O3S.C20H16ClF3N4O4.2C19H14Cl2F3N5O3S.C19H13Cl2F3N4O3S/c1-13(8-20(36)23-22(26)24(32-12-31-23)33-16-4-6-30-7-5-16)18-11-21(37-35-18)19-10-14-9-15(25(27,28)29)2-3-17(14)34-19;1-10(6-12(30)15-14(23)18(32-5)27-9-26-15)19-24-8-13(33-19)17(31)29-20-25-7-11(22)16(28-20)21(2,3)4;1-10(6-12(30)16-15(22)19(32-5)26-9-25-16)20-24-8-13(33-20)18(31)27-14-7-11(21(2,3)4)17(23)29-28-14;1-10-4-5-12(7-13(10)21(23,24)25)28-19(31)16-8-14(29-33-16)11(2)6-15(30)18-17(22)20(32-3)27-9-26-18;1-10(5-16(30)19-18(22)20(31-2)27-9-26-19)17-8-15(29-32-17)14-7-11-6-12(21(23,24)25)3-4-13(11)28-14;1-9(5-13(30)16-15(22)18(32-2)28-8-27-16)19-26-7-14(33-19)17(31)29-10-3-4-12(21)11(6-10)20(23,24)25;1-9(5-13(30)16-15(22)18(32-2)28-8-27-16)19-26-7-14(33-19)17(31)29-10-3-4-11(12(21)6-10)20(23,24)25;1-10-3-4-11(7-13(10)20(22,23)24)27-18(30)15-8-12(28-32-15)5-6-14(29)17-16(21)19(31-2)26-9-25-17;2*1-8(3-11(30)15-14(21)17(32-2)28-7-27-15)18-26-6-12(33-18)16(31)29-13-4-9(19(22,23)24)10(20)5-25-13;1-31-18-15(21)16(26-8-27-18)12(29)4-5-14-25-7-13(32-14)17(30)28-9-2-3-11(20)10(6-9)19(22,23)24/h2-7,9,11-13H,8,10H2,1H3,(H,30,31,32,33);7-10H,6H2,1-5H3,(H,25,28,29,31);7-10H,6H2,1-5H3,(H,27,28,31);4-5,7-9,11H,6H2,1-3H3,(H,28,31);3-4,6,8-10H,5,7H2,1-2H3;2*3-4,6-9H,5H2,1-2H3,(H,29,31);3-4,7-9H,5-6H2,1-2H3,(H,27,30);2*4-8H,3H2,1-2H3,(H,25,29,31);2-3,6-8H,4-5H2,1H3,(H,28,30)/t13-;;;11-;10-;9-;;;8-;;/m1..110..1../s1
InChIKeyIKWNDKSEAFQGSS-HSOBMDNGSA-N
MW5546.85 g/mol
LogP58.77
Rot. Bonds76

About N-(5-tert-butyl-6-chloropyridazin-3-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-(4-tert-butyl-5-chloropyrimidin-2-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;2-[(2S)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[3-chloro-4-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;3-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;2-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;3-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;(3R)-1-(5-chloro-6-methoxypyrimidin-4-yl)-3-[3-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-5-yl]butan-1-one;(3R)-1-[5-chloro-6-(pyridin-4-ylamino)pyrimidin-4-yl]-3-[5-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-3-yl]butan-1-one

N-(5-tert-butyl-6-chloropyridazin-3-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-(4-tert-butyl-5-chloropyrimidin-2-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;2-[(2S)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[3-chloro-4-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;3-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;2-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;3-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;(3R)-1-(5-chloro-6-methoxypyrimidin-4-yl)-3-[3-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-5-yl]butan-1-one;(3R)-1-[5-chloro-6-(pyridin-4-ylamino)pyrimidin-4-yl]-3-[5-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-3-yl]butan-1-one (PubChem CID 158729117) has the molecular formula C226H183Cl18F27N52O34S7 and a molecular weight of 5546.85 g/mol. Its IUPAC name is N-(5-tert-butyl-6-chloropyridazin-3-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-(4-tert-butyl-5-chloropyrimidin-2-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;2-[(2S)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[3-chloro-4-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;3-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;2-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;3-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;(3R)-1-(5-chloro-6-methoxypyrimidin-4-yl)-3-[3-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-5-yl]butan-1-one;(3R)-1-[5-chloro-6-(pyridin-4-ylamino)pyrimidin-4-yl]-3-[5-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-3-yl]butan-1-one.

Molecular Properties

Compound NameN-(5-tert-butyl-6-chloropyridazin-3-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-(4-tert-butyl-5-chloropyrimidin-2-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;2-[(2S)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[3-chloro-4-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;3-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;2-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;3-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;(3R)-1-(5-chloro-6-methoxypyrimidin-4-yl)-3-[3-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-5-yl]butan-1-one;(3R)-1-[5-chloro-6-(pyridin-4-ylamino)pyrimidin-4-yl]-3-[5-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-3-yl]butan-1-one
PubChem CID158729117
Molecular FormulaC226H183Cl18F27N52O34S7
Molecular Weight5546.85 g/mol
Exact Mass5534.62
IUPAC NameN-(5-tert-butyl-6-chloropyridazin-3-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-(4-tert-butyl-5-chloropyrimidin-2-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;2-[(2S)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[3-chloro-4-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;3-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;2-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;3-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;(3R)-1-(5-chloro-6-methoxypyrimidin-4-yl)-3-[3-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-5-yl]butan-1-one;(3R)-1-[5-chloro-6-(pyridin-4-ylamino)pyrimidin-4-yl]-3-[5-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-3-yl]butan-1-one
SMILESCOc1ncnc(C(=O)CC(C)c2ncc(C(=O)Nc3cc(C(C)(C)C)c(Cl)nn3)s2)c1Cl.COc1ncnc(C(=O)CC(C)c2ncc(C(=O)Nc3cc(C(F)(F)F)c(Cl)cn3)s2)c1Cl.COc1ncnc(C(=O)CC(C)c2ncc(C(=O)Nc3ccc(C(F)(F)F)c(Cl)c3)s2)c1Cl.COc1ncnc(C(=O)CC(C)c2ncc(C(=O)Nc3ncc(Cl)c(C(C)(C)C)n3)s2)c1Cl.COc1ncnc(C(=O)CCc2cc(C(=O)Nc3ccc(C)c(C(F)(F)F)c3)on2)c1Cl.COc1ncnc(C(=O)CCc2ncc(C(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)s2)c1Cl.COc1ncnc(C(=O)C[C@@H](C)c2cc(C(=O)Nc3ccc(C)c(C(F)(F)F)c3)on2)c1Cl.COc1ncnc(C(=O)C[C@@H](C)c2cc(C3=Nc4ccc(C(F)(F)F)cc4C3)no2)c1Cl.COc1ncnc(C(=O)C[C@@H](C)c2ncc(C(=O)Nc3cc(C(F)(F)F)c(Cl)cn3)s2)c1Cl.COc1ncnc(C(=O)C[C@H](C)c2ncc(C(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)s2)c1Cl.C[C@H](CC(=O)c1ncnc(Nc2ccncc2)c1Cl)c1cc(C2=Nc3ccc(C(F)(F)F)cc3C2)on1
InChIInChI=1S/C25H18ClF3N6O2.2C21H22Cl2N6O3S.C21H18ClF3N4O4.C21H16ClF3N4O3.2C20H15Cl2F3N4O3S.C20H16ClF3N4O4.2C19H14Cl2F3N5O3S.C19H13Cl2F3N4O3S/c1-13(8-20(36)23-22(26)24(32-12-31-23)33-16-4-6-30-7-5-16)18-11-21(37-35-18)19-10-14-9-15(25(27,28)29)2-3-17(14)34-19;1-10(6-12(30)15-14(23)18(32-5)27-9-26-15)19-24-8-13(33-19)17(31)29-20-25-7-11(22)16(28-20)21(2,3)4;1-10(6-12(30)16-15(22)19(32-5)26-9-25-16)20-24-8-13(33-20)18(31)27-14-7-11(21(2,3)4)17(23)29-28-14;1-10-4-5-12(7-13(10)21(23,24)25)28-19(31)16-8-14(29-33-16)11(2)6-15(30)18-17(22)20(32-3)27-9-26-18;1-10(5-16(30)19-18(22)20(31-2)27-9-26-19)17-8-15(29-32-17)14-7-11-6-12(21(23,24)25)3-4-13(11)28-14;1-9(5-13(30)16-15(22)18(32-2)28-8-27-16)19-26-7-14(33-19)17(31)29-10-3-4-12(21)11(6-10)20(23,24)25;1-9(5-13(30)16-15(22)18(32-2)28-8-27-16)19-26-7-14(33-19)17(31)29-10-3-4-11(12(21)6-10)20(23,24)25;1-10-3-4-11(7-13(10)20(22,23)24)27-18(30)15-8-12(28-32-15)5-6-14(29)17-16(21)19(31-2)26-9-25-17;2*1-8(3-11(30)15-14(21)17(32-2)28-7-27-15)18-26-6-12(33-18)16(31)29-13-4-9(19(22,23)24)10(20)5-25-13;1-31-18-15(21)16(26-8-27-18)12(29)4-5-14-25-7-13(32-14)17(30)28-9-2-3-11(20)10(6-9)19(22,23)24/h2-7,9,11-13H,8,10H2,1H3,(H,30,31,32,33);7-10H,6H2,1-5H3,(H,25,28,29,31);7-10H,6H2,1-5H3,(H,27,28,31);4-5,7-9,11H,6H2,1-3H3,(H,28,31);3-4,6,8-10H,5,7H2,1-2H3;2*3-4,6-9H,5H2,1-2H3,(H,29,31);3-4,7-9H,5-6H2,1-2H3,(H,27,30);2*4-8H,3H2,1-2H3,(H,25,29,31);2-3,6-8H,4-5H2,1H3,(H,28,30)/t13-;;;11-;10-;9-;;;8-;;/m1..110..1../s1
InChIKeyIKWNDKSEAFQGSS-HSOBMDNGSA-N
XLogP58.77
TPSA1146.88 Ų
H-Bond Donors10
H-Bond Acceptors84
Rotatable Bonds76
Heavy Atoms364
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005546.85
LogP ≤ 558.77
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1084

Analyze N-(5-tert-butyl-6-chloropyridazin-3-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-(4-tert-butyl-5-chloropyrimidin-2-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;2-[(2S)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[3-chloro-4-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;3-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;2-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;3-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;(3R)-1-(5-chloro-6-methoxypyrimidin-4-yl)-3-[3-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-5-yl]butan-1-one;(3R)-1-[5-chloro-6-(pyridin-4-ylamino)pyrimidin-4-yl]-3-[5-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-3-yl]butan-1-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(5-tert-butyl-6-chloropyridazin-3-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-(4-tert-butyl-5-chloropyrimidin-2-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;2-[(2S)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[3-chloro-4-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;3-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;2-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;3-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;(3R)-1-(5-chloro-6-methoxypyrimidin-4-yl)-3-[3-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-5-yl]butan-1-one;(3R)-1-[5-chloro-6-(pyridin-4-ylamino)pyrimidin-4-yl]-3-[5-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-3-yl]butan-1-one?
The IUPAC name of N-(5-tert-butyl-6-chloropyridazin-3-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-(4-tert-butyl-5-chloropyrimidin-2-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;2-[(2S)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[3-chloro-4-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;3-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;2-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;3-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;(3R)-1-(5-chloro-6-methoxypyrimidin-4-yl)-3-[3-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-5-yl]butan-1-one;(3R)-1-[5-chloro-6-(pyridin-4-ylamino)pyrimidin-4-yl]-3-[5-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-3-yl]butan-1-one (CID 158729117) is N-(5-tert-butyl-6-chloropyridazin-3-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-(4-tert-butyl-5-chloropyrimidin-2-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;2-[(2S)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[3-chloro-4-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;3-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;2-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;3-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;(3R)-1-(5-chloro-6-methoxypyrimidin-4-yl)-3-[3-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-5-yl]butan-1-one;(3R)-1-[5-chloro-6-(pyridin-4-ylamino)pyrimidin-4-yl]-3-[5-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-3-yl]butan-1-one.
What is the SMILES notation for N-(5-tert-butyl-6-chloropyridazin-3-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-(4-tert-butyl-5-chloropyrimidin-2-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;2-[(2S)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[3-chloro-4-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;3-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;2-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;3-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;(3R)-1-(5-chloro-6-methoxypyrimidin-4-yl)-3-[3-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-5-yl]butan-1-one;(3R)-1-[5-chloro-6-(pyridin-4-ylamino)pyrimidin-4-yl]-3-[5-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-3-yl]butan-1-one?
The canonical SMILES for N-(5-tert-butyl-6-chloropyridazin-3-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-(4-tert-butyl-5-chloropyrimidin-2-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;2-[(2S)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[3-chloro-4-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;3-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;2-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;3-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;(3R)-1-(5-chloro-6-methoxypyrimidin-4-yl)-3-[3-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-5-yl]butan-1-one;(3R)-1-[5-chloro-6-(pyridin-4-ylamino)pyrimidin-4-yl]-3-[5-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-3-yl]butan-1-one is COc1ncnc(C(=O)CC(C)c2ncc(C(=O)Nc3cc(C(C)(C)C)c(Cl)nn3)s2)c1Cl.COc1ncnc(C(=O)CC(C)c2ncc(C(=O)Nc3cc(C(F)(F)F)c(Cl)cn3)s2)c1Cl.COc1ncnc(C(=O)CC(C)c2ncc(C(=O)Nc3ccc(C(F)(F)F)c(Cl)c3)s2)c1Cl.COc1ncnc(C(=O)CC(C)c2ncc(C(=O)Nc3ncc(Cl)c(C(C)(C)C)n3)s2)c1Cl.COc1ncnc(C(=O)CCc2cc(C(=O)Nc3ccc(C)c(C(F)(F)F)c3)on2)c1Cl.COc1ncnc(C(=O)CCc2ncc(C(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)s2)c1Cl.COc1ncnc(C(=O)C[C@@H](C)c2cc(C(=O)Nc3ccc(C)c(C(F)(F)F)c3)on2)c1Cl.COc1ncnc(C(=O)C[C@@H](C)c2cc(C3=Nc4ccc(C(F)(F)F)cc4C3)no2)c1Cl.COc1ncnc(C(=O)C[C@@H](C)c2ncc(C(=O)Nc3cc(C(F)(F)F)c(Cl)cn3)s2)c1Cl.COc1ncnc(C(=O)C[C@H](C)c2ncc(C(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)s2)c1Cl.C[C@H](CC(=O)c1ncnc(Nc2ccncc2)c1Cl)c1cc(C2=Nc3ccc(C(F)(F)F)cc3C2)on1.
What is the InChIKey of N-(5-tert-butyl-6-chloropyridazin-3-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-(4-tert-butyl-5-chloropyrimidin-2-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;2-[(2S)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[3-chloro-4-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;3-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;2-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;3-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;(3R)-1-(5-chloro-6-methoxypyrimidin-4-yl)-3-[3-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-5-yl]butan-1-one;(3R)-1-[5-chloro-6-(pyridin-4-ylamino)pyrimidin-4-yl]-3-[5-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-3-yl]butan-1-one?
The InChIKey is IKWNDKSEAFQGSS-HSOBMDNGSA-N. The full InChI is InChI=1S/C25H18ClF3N6O2.2C21H22Cl2N6O3S.C21H18ClF3N4O4.C21H16ClF3N4O3.2C20H15Cl2F3N4O3S.C20H16ClF3N4O4.2C19H14Cl2F3N5O3S.C19H13Cl2F3N4O3S/c1-13(8-20(36)23-22(26)24(32-12-31-23)33-16-4-6-30-7-5-16)18-11-21(37-35-18)19-10-14-9-15(25(27,28)29)2-3-17(14)34-19;1-10(6-12(30)15-14(23)18(32-5)27-9-26-15)19-24-8-13(33-19)17(31)29-20-25-7-11(22)16(28-20)21(2,3)4;1-10(6-12(30)16-15(22)19(32-5)26-9-25-16)20-24-8-13(33-20)18(31)27-14-7-11(21(2,3)4)17(23)29-28-14;1-10-4-5-12(7-13(10)21(23,24)25)28-19(31)16-8-14(29-33-16)11(2)6-15(30)18-17(22)20(32-3)27-9-26-18;1-10(5-16(30)19-18(22)20(31-2)27-9-26-19)17-8-15(29-32-17)14-7-11-6-12(21(23,24)25)3-4-13(11)28-14;1-9(5-13(30)16-15(22)18(32-2)28-8-27-16)19-26-7-14(33-19)17(31)29-10-3-4-12(21)11(6-10)20(23,24)25;1-9(5-13(30)16-15(22)18(32-2)28-8-27-16)19-26-7-14(33-19)17(31)29-10-3-4-11(12(21)6-10)20(23,24)25;1-10-3-4-11(7-13(10)20(22,23)24)27-18(30)15-8-12(28-32-15)5-6-14(29)17-16(21)19(31-2)26-9-25-17;2*1-8(3-11(30)15-14(21)17(32-2)28-7-27-15)18-26-6-12(33-18)16(31)29-13-4-9(19(22,23)24)10(20)5-25-13;1-31-18-15(21)16(26-8-27-18)12(29)4-5-14-25-7-13(32-14)17(30)28-9-2-3-11(20)10(6-9)19(22,23)24/h2-7,9,11-13H,8,10H2,1H3,(H,30,31,32,33);7-10H,6H2,1-5H3,(H,25,28,29,31);7-10H,6H2,1-5H3,(H,27,28,31);4-5,7-9,11H,6H2,1-3H3,(H,28,31);3-4,6,8-10H,5,7H2,1-2H3;2*3-4,6-9H,5H2,1-2H3,(H,29,31);3-4,7-9H,5-6H2,1-2H3,(H,27,30);2*4-8H,3H2,1-2H3,(H,25,29,31);2-3,6-8H,4-5H2,1H3,(H,28,30)/t13-;;;11-;10-;9-;;;8-;;/m1..110..1../s1.
What are the key properties of N-(5-tert-butyl-6-chloropyridazin-3-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-(4-tert-butyl-5-chloropyrimidin-2-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;2-[(2S)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[3-chloro-4-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;3-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;2-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;3-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;(3R)-1-(5-chloro-6-methoxypyrimidin-4-yl)-3-[3-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-5-yl]butan-1-one;(3R)-1-[5-chloro-6-(pyridin-4-ylamino)pyrimidin-4-yl]-3-[5-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-3-yl]butan-1-one?
N-(5-tert-butyl-6-chloropyridazin-3-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-(4-tert-butyl-5-chloropyrimidin-2-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;2-[(2S)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[3-chloro-4-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;3-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;2-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;3-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;(3R)-1-(5-chloro-6-methoxypyrimidin-4-yl)-3-[3-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-5-yl]butan-1-one;(3R)-1-[5-chloro-6-(pyridin-4-ylamino)pyrimidin-4-yl]-3-[5-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-3-yl]butan-1-one has a molecular weight of 5546.85 g/mol, XLogP of 58.77, 76 rotatable bonds, 10 hydrogen bond donors, and 84 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-tert-butyl-6-chloropyridazin-3-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-(4-tert-butyl-5-chloropyrimidin-2-yl)-2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;2-[(2S)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[3-chloro-4-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;2-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;2-[4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-5-carboxamide;3-[(2R)-4-(5-chloro-6-methoxypyrimidin-4-yl)-4-oxobutan-2-yl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;2-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide;3-[3-(5-chloro-6-methoxypyrimidin-4-yl)-3-oxopropyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide;(3R)-1-(5-chloro-6-methoxypyrimidin-4-yl)-3-[3-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-5-yl]butan-1-one;(3R)-1-[5-chloro-6-(pyridin-4-ylamino)pyrimidin-4-yl]-3-[5-[5-(trifluoromethyl)-3H-indol-2-yl]-1,2-oxazol-3-yl]butan-1-one is sourced from PubChem (CID 158729117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).