5-[3-chloro-5-(2-methyloxolan-3-yl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyridin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-2-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-methyl-5-pyrimidin-4-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-methyl-5-(1,3-thiazol-5-yl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-pyridin-3-ylanilino)pyridine-2-carbohydrazide;bis(N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-pyrimidin-4-yl-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide)

C246H224Cl5F16N85O21S — CID 158170789

IUPAC5-[3-chloro-5-(2-methyloxolan-3-yl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyridin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-2-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-methyl-5-pyrimidin-4-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-methyl-5-(1,3-thiazol-5-yl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-pyridin-3-ylanilino)pyridine-2-carbohydrazide;bis(N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-pyrimidin-4-yl-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide)
SMILESCC1OCCC1c1cc(Cl)cc(Nc2ccc(C(=O)NNc3ncc(F)c(N4CCOCC4)n3)nc2)c1.Cc1cc(Nc2ccc(C(=O)NNc3ncc(F)c(N4CCOCC4)n3)nc2)cc(-c2ccncn2)c1.Cc1cc(Nc2ccc(C(=O)NNc3ncc(F)c(N4CCOCC4)n3)nc2)cc(-c2cncs2)c1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cc(-c3ccncn3)cc(C(F)(F)F)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cc(-c3ccncn3)cc(C(F)(F)F)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cc(Cl)cc(-c3cccnc3)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cc(Cl)cc(-c3ccncn3)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cc(Cl)cc(-c3cncnc3)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cc(Cl)cc(-c3ncccn3)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cccc(-c3cccnc3)c2)cn1
InChIInChI=1S/C25H22ClFN8O2.C25H27ClFN7O3.2C25H21F4N9O2.C25H24FN9O2.C25H23FN8O2.3C24H21ClFN9O2.C24H23FN8O2S/c26-18-10-17(16-2-1-5-28-13-16)11-20(12-18)31-19-3-4-22(29-14-19)24(36)33-34-25-30-15-21(27)23(32-25)35-6-8-37-9-7-35;1-15-20(4-7-37-15)16-10-17(26)12-19(11-16)30-18-2-3-22(28-13-18)24(35)32-33-25-29-14-21(27)23(31-25)34-5-8-36-9-6-34;2*26-19-13-32-24(35-22(19)38-5-7-40-8-6-38)37-36-23(39)21-2-1-17(12-31-21)34-18-10-15(20-3-4-30-14-33-20)9-16(11-18)25(27,28)29;1-16-10-17(21-4-5-27-15-30-21)12-19(11-16)31-18-2-3-22(28-13-18)24(36)33-34-25-29-14-20(26)23(32-25)35-6-8-37-9-7-35;26-21-16-29-25(31-23(21)34-9-11-36-12-10-34)33-32-24(35)22-7-6-20(15-28-22)30-19-5-1-3-17(13-19)18-4-2-8-27-14-18;25-16-10-15(21-27-4-1-5-28-21)11-18(12-16)31-17-2-3-20(29-13-17)23(36)33-34-24-30-14-19(26)22(32-24)35-6-8-37-9-7-35;25-17-7-15(16-10-27-14-28-11-16)8-19(9-17)31-18-1-2-21(29-12-18)23(36)33-34-24-30-13-20(26)22(32-24)35-3-5-37-6-4-35;25-16-9-15(20-3-4-27-14-30-20)10-18(11-16)31-17-1-2-21(28-12-17)23(36)33-34-24-29-13-19(26)22(32-24)35-5-7-37-8-6-35;1-15-8-16(21-13-26-14-36-21)10-18(9-15)29-17-2-3-20(27-11-17)23(34)31-32-24-28-12-19(25)22(30-24)33-4-6-35-7-5-33/h1-5,10-15,31H,6-9H2,(H,33,36)(H,30,32,34);2-3,10-15,20,30H,4-9H2,1H3,(H,32,35)(H,29,31,33);2*1-4,9-14,34H,5-8H2,(H,36,39)(H,32,35,37);2-5,10-15,31H,6-9H2,1H3,(H,33,36)(H,29,32,34);1-8,13-16,30H,9-12H2,(H,32,35)(H,29,31,33);1-5,10-14,31H,6-9H2,(H,33,36)(H,30,32,34);1-2,7-14,31H,3-6H2,(H,33,36)(H,30,32,34);1-4,9-14,31H,5-8H2,(H,33,36)(H,29,32,34);2-3,8-14,29H,4-7H2,1H3,(H,31,34)(H,28,30,32)
InChIKeyFXKPOIQWPMSUMF-UHFFFAOYSA-N
MW5220.37 g/mol
LogP36.28
Rot. Bonds70

About 5-[3-chloro-5-(2-methyloxolan-3-yl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyridin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-2-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-methyl-5-pyrimidin-4-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-methyl-5-(1,3-thiazol-5-yl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-pyridin-3-ylanilino)pyridine-2-carbohydrazide;bis(N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-pyrimidin-4-yl-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide)

5-[3-chloro-5-(2-methyloxolan-3-yl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyridin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-2-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-methyl-5-pyrimidin-4-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-methyl-5-(1,3-thiazol-5-yl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-pyridin-3-ylanilino)pyridine-2-carbohydrazide;bis(N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-pyrimidin-4-yl-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide) (PubChem CID 158170789) has the molecular formula C246H224Cl5F16N85O21S and a molecular weight of 5220.37 g/mol. Its IUPAC name is 5-[3-chloro-5-(2-methyloxolan-3-yl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyridin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-2-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-methyl-5-pyrimidin-4-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-methyl-5-(1,3-thiazol-5-yl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-pyridin-3-ylanilino)pyridine-2-carbohydrazide;bis(N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-pyrimidin-4-yl-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide).

Molecular Properties

Compound Name5-[3-chloro-5-(2-methyloxolan-3-yl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyridin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-2-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-methyl-5-pyrimidin-4-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-methyl-5-(1,3-thiazol-5-yl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-pyridin-3-ylanilino)pyridine-2-carbohydrazide;bis(N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-pyrimidin-4-yl-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide)
PubChem CID158170789
Molecular FormulaC246H224Cl5F16N85O21S
Molecular Weight5220.37 g/mol
Exact Mass5214.70
IUPAC Name5-[3-chloro-5-(2-methyloxolan-3-yl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyridin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-2-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-methyl-5-pyrimidin-4-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-methyl-5-(1,3-thiazol-5-yl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-pyridin-3-ylanilino)pyridine-2-carbohydrazide;bis(N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-pyrimidin-4-yl-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide)
SMILESCC1OCCC1c1cc(Cl)cc(Nc2ccc(C(=O)NNc3ncc(F)c(N4CCOCC4)n3)nc2)c1.Cc1cc(Nc2ccc(C(=O)NNc3ncc(F)c(N4CCOCC4)n3)nc2)cc(-c2ccncn2)c1.Cc1cc(Nc2ccc(C(=O)NNc3ncc(F)c(N4CCOCC4)n3)nc2)cc(-c2cncs2)c1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cc(-c3ccncn3)cc(C(F)(F)F)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cc(-c3ccncn3)cc(C(F)(F)F)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cc(Cl)cc(-c3cccnc3)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cc(Cl)cc(-c3ccncn3)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cc(Cl)cc(-c3cncnc3)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cc(Cl)cc(-c3ncccn3)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cccc(-c3cccnc3)c2)cn1
InChIInChI=1S/C25H22ClFN8O2.C25H27ClFN7O3.2C25H21F4N9O2.C25H24FN9O2.C25H23FN8O2.3C24H21ClFN9O2.C24H23FN8O2S/c26-18-10-17(16-2-1-5-28-13-16)11-20(12-18)31-19-3-4-22(29-14-19)24(36)33-34-25-30-15-21(27)23(32-25)35-6-8-37-9-7-35;1-15-20(4-7-37-15)16-10-17(26)12-19(11-16)30-18-2-3-22(28-13-18)24(35)32-33-25-29-14-21(27)23(31-25)34-5-8-36-9-6-34;2*26-19-13-32-24(35-22(19)38-5-7-40-8-6-38)37-36-23(39)21-2-1-17(12-31-21)34-18-10-15(20-3-4-30-14-33-20)9-16(11-18)25(27,28)29;1-16-10-17(21-4-5-27-15-30-21)12-19(11-16)31-18-2-3-22(28-13-18)24(36)33-34-25-29-14-20(26)23(32-25)35-6-8-37-9-7-35;26-21-16-29-25(31-23(21)34-9-11-36-12-10-34)33-32-24(35)22-7-6-20(15-28-22)30-19-5-1-3-17(13-19)18-4-2-8-27-14-18;25-16-10-15(21-27-4-1-5-28-21)11-18(12-16)31-17-2-3-20(29-13-17)23(36)33-34-24-30-14-19(26)22(32-24)35-6-8-37-9-7-35;25-17-7-15(16-10-27-14-28-11-16)8-19(9-17)31-18-1-2-21(29-12-18)23(36)33-34-24-30-13-20(26)22(32-24)35-3-5-37-6-4-35;25-16-9-15(20-3-4-27-14-30-20)10-18(11-16)31-17-1-2-21(28-12-17)23(36)33-34-24-29-13-19(26)22(32-24)35-5-7-37-8-6-35;1-15-8-16(21-13-26-14-36-21)10-18(9-15)29-17-2-3-20(27-11-17)23(34)31-32-24-28-12-19(25)22(30-24)33-4-6-35-7-5-33/h1-5,10-15,31H,6-9H2,(H,33,36)(H,30,32,34);2-3,10-15,20,30H,4-9H2,1H3,(H,32,35)(H,29,31,33);2*1-4,9-14,34H,5-8H2,(H,36,39)(H,32,35,37);2-5,10-15,31H,6-9H2,1H3,(H,33,36)(H,29,32,34);1-8,13-16,30H,9-12H2,(H,32,35)(H,29,31,33);1-5,10-14,31H,6-9H2,(H,33,36)(H,30,32,34);1-2,7-14,31H,3-6H2,(H,33,36)(H,30,32,34);1-4,9-14,31H,5-8H2,(H,33,36)(H,29,32,34);2-3,8-14,29H,4-7H2,1H3,(H,31,34)(H,28,30,32)
InChIKeyFXKPOIQWPMSUMF-UHFFFAOYSA-N
XLogP36.28
TPSA1245.58 Ų
H-Bond Donors30
H-Bond Acceptors97
Rotatable Bonds70
Heavy Atoms374
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005220.37
LogP ≤ 536.28
H-Bond Donors ≤ 530
H-Bond Acceptors ≤ 1097

Analyze 5-[3-chloro-5-(2-methyloxolan-3-yl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyridin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-2-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-methyl-5-pyrimidin-4-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-methyl-5-(1,3-thiazol-5-yl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-pyridin-3-ylanilino)pyridine-2-carbohydrazide;bis(N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-pyrimidin-4-yl-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-[3-chloro-5-(2-methyloxolan-3-yl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyridin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-2-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-methyl-5-pyrimidin-4-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-methyl-5-(1,3-thiazol-5-yl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-pyridin-3-ylanilino)pyridine-2-carbohydrazide;bis(N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-pyrimidin-4-yl-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide)?
The IUPAC name of 5-[3-chloro-5-(2-methyloxolan-3-yl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyridin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-2-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-methyl-5-pyrimidin-4-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-methyl-5-(1,3-thiazol-5-yl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-pyridin-3-ylanilino)pyridine-2-carbohydrazide;bis(N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-pyrimidin-4-yl-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide) (CID 158170789) is 5-[3-chloro-5-(2-methyloxolan-3-yl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyridin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-2-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-methyl-5-pyrimidin-4-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-methyl-5-(1,3-thiazol-5-yl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-pyridin-3-ylanilino)pyridine-2-carbohydrazide;bis(N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-pyrimidin-4-yl-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide).
What is the SMILES notation for 5-[3-chloro-5-(2-methyloxolan-3-yl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyridin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-2-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-methyl-5-pyrimidin-4-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-methyl-5-(1,3-thiazol-5-yl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-pyridin-3-ylanilino)pyridine-2-carbohydrazide;bis(N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-pyrimidin-4-yl-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide)?
The canonical SMILES for 5-[3-chloro-5-(2-methyloxolan-3-yl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyridin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-2-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-methyl-5-pyrimidin-4-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-methyl-5-(1,3-thiazol-5-yl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-pyridin-3-ylanilino)pyridine-2-carbohydrazide;bis(N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-pyrimidin-4-yl-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide) is CC1OCCC1c1cc(Cl)cc(Nc2ccc(C(=O)NNc3ncc(F)c(N4CCOCC4)n3)nc2)c1.Cc1cc(Nc2ccc(C(=O)NNc3ncc(F)c(N4CCOCC4)n3)nc2)cc(-c2ccncn2)c1.Cc1cc(Nc2ccc(C(=O)NNc3ncc(F)c(N4CCOCC4)n3)nc2)cc(-c2cncs2)c1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cc(-c3ccncn3)cc(C(F)(F)F)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cc(-c3ccncn3)cc(C(F)(F)F)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cc(Cl)cc(-c3cccnc3)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cc(Cl)cc(-c3ccncn3)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cc(Cl)cc(-c3cncnc3)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cc(Cl)cc(-c3ncccn3)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cccc(-c3cccnc3)c2)cn1.
What is the InChIKey of 5-[3-chloro-5-(2-methyloxolan-3-yl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyridin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-2-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-methyl-5-pyrimidin-4-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-methyl-5-(1,3-thiazol-5-yl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-pyridin-3-ylanilino)pyridine-2-carbohydrazide;bis(N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-pyrimidin-4-yl-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide)?
The InChIKey is FXKPOIQWPMSUMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22ClFN8O2.C25H27ClFN7O3.2C25H21F4N9O2.C25H24FN9O2.C25H23FN8O2.3C24H21ClFN9O2.C24H23FN8O2S/c26-18-10-17(16-2-1-5-28-13-16)11-20(12-18)31-19-3-4-22(29-14-19)24(36)33-34-25-30-15-21(27)23(32-25)35-6-8-37-9-7-35;1-15-20(4-7-37-15)16-10-17(26)12-19(11-16)30-18-2-3-22(28-13-18)24(35)32-33-25-29-14-21(27)23(31-25)34-5-8-36-9-6-34;2*26-19-13-32-24(35-22(19)38-5-7-40-8-6-38)37-36-23(39)21-2-1-17(12-31-21)34-18-10-15(20-3-4-30-14-33-20)9-16(11-18)25(27,28)29;1-16-10-17(21-4-5-27-15-30-21)12-19(11-16)31-18-2-3-22(28-13-18)24(36)33-34-25-29-14-20(26)23(32-25)35-6-8-37-9-7-35;26-21-16-29-25(31-23(21)34-9-11-36-12-10-34)33-32-24(35)22-7-6-20(15-28-22)30-19-5-1-3-17(13-19)18-4-2-8-27-14-18;25-16-10-15(21-27-4-1-5-28-21)11-18(12-16)31-17-2-3-20(29-13-17)23(36)33-34-24-30-14-19(26)22(32-24)35-6-8-37-9-7-35;25-17-7-15(16-10-27-14-28-11-16)8-19(9-17)31-18-1-2-21(29-12-18)23(36)33-34-24-30-13-20(26)22(32-24)35-3-5-37-6-4-35;25-16-9-15(20-3-4-27-14-30-20)10-18(11-16)31-17-1-2-21(28-12-17)23(36)33-34-24-29-13-19(26)22(32-24)35-5-7-37-8-6-35;1-15-8-16(21-13-26-14-36-21)10-18(9-15)29-17-2-3-20(27-11-17)23(34)31-32-24-28-12-19(25)22(30-24)33-4-6-35-7-5-33/h1-5,10-15,31H,6-9H2,(H,33,36)(H,30,32,34);2-3,10-15,20,30H,4-9H2,1H3,(H,32,35)(H,29,31,33);2*1-4,9-14,34H,5-8H2,(H,36,39)(H,32,35,37);2-5,10-15,31H,6-9H2,1H3,(H,33,36)(H,29,32,34);1-8,13-16,30H,9-12H2,(H,32,35)(H,29,31,33);1-5,10-14,31H,6-9H2,(H,33,36)(H,30,32,34);1-2,7-14,31H,3-6H2,(H,33,36)(H,30,32,34);1-4,9-14,31H,5-8H2,(H,33,36)(H,29,32,34);2-3,8-14,29H,4-7H2,1H3,(H,31,34)(H,28,30,32).
What are the key properties of 5-[3-chloro-5-(2-methyloxolan-3-yl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyridin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-2-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-methyl-5-pyrimidin-4-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-methyl-5-(1,3-thiazol-5-yl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-pyridin-3-ylanilino)pyridine-2-carbohydrazide;bis(N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-pyrimidin-4-yl-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide)?
5-[3-chloro-5-(2-methyloxolan-3-yl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyridin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-2-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-methyl-5-pyrimidin-4-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-methyl-5-(1,3-thiazol-5-yl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-pyridin-3-ylanilino)pyridine-2-carbohydrazide;bis(N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-pyrimidin-4-yl-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide) has a molecular weight of 5220.37 g/mol, XLogP of 36.28, 70 rotatable bonds, 30 hydrogen bond donors, and 97 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-chloro-5-(2-methyloxolan-3-yl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyridin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-2-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-5-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-methyl-5-pyrimidin-4-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-methyl-5-(1,3-thiazol-5-yl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(3-pyridin-3-ylanilino)pyridine-2-carbohydrazide;bis(N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-pyrimidin-4-yl-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide) is sourced from PubChem (CID 158170789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).