3-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(4-[2-fluoro-5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);bis(4-[4-fluoro-3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);3-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid);5-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid);2-hydroxy-5-[(2-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;bis(5-[(3-propan-2-ylphenyl)diazenyl]benzene-1,3-dicarboxylic acid);1-(5-propan-2-yl-3-pyridinyl)-3-[5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]-3-pyridinyl]propan-2-one;1-(5-propan-2-yl-3-pyridinyl)-2-[5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-3-pyridinyl]hydrazine

C347H308F37N49O35S6 — CID 157392684

IUPAC3-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(4-[2-fluoro-5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);bis(4-[4-fluoro-3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);3-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid);5-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid);2-hydroxy-5-[(2-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;bis(5-[(3-propan-2-ylphenyl)diazenyl]benzene-1,3-dicarboxylic acid);1-(5-propan-2-yl-3-pyridinyl)-3-[5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]-3-pyridinyl]propan-2-one;1-(5-propan-2-yl-3-pyridinyl)-2-[5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-3-pyridinyl]hydrazine
SMILESCC(C)c1cc(/N=N/c2ccc(F)c(-c3csc(Nc4cccc(C(F)(F)F)c4)n3)c2)ccc1F.CC(C)c1cc(/N=N/c2ccc(F)c(-c3csc(Nc4cccc(C(F)(F)F)c4)n3)c2)ccc1F.CC(C)c1cc(/N=N/c2ccc(O)c(C(=O)O)c2)c(F)cc1F.CC(C)c1cc(/N=N/c2ccc(O)c(C(=O)O)c2)ccc1F.CC(C)c1cc(/N=N/c2ccc(O)c(C(=O)O)c2)ccc1F.CC(C)c1cc(/N=N/c2cccc(C(=O)O)c2)c(F)cc1F.CC(C)c1ccc(F)c(/N=N/c2cc(-c3csc(Nc4cccc(C(F)(F)F)c4)n3)ccc2F)c1.CC(C)c1ccc(F)c(/N=N/c2cc(-c3csc(Nc4cccc(C(F)(F)F)c4)n3)ccc2F)c1.CC(C)c1ccc(F)c(/N=N/c2ccc(O)c(C(=O)O)c2)c1.CC(C)c1ccc(F)c(/N=N/c2cccc(C(=O)O)c2)c1.CC(C)c1ccc(F)c(/N=N/c2cccc(C(=O)O)c2)c1.CC(C)c1cccc(/N=N/c2cc(C(=O)O)cc(C(=O)O)c2)c1.CC(C)c1cccc(/N=N/c2cc(C(=O)O)cc(C(=O)O)c2)c1.CC(C)c1cncc(CC(=O)Cc2cncc(-c3csc(Nc4cccc(C(F)(F)F)c4)n3)c2)c1.CC(C)c1cncc(NNc2cncc(-c3csc(Cc4cccc(C(F)(F)F)c4)n3)c2)c1.Cc1cc(F)c(/N=N/c2ccc(O)c(C(=O)O)c2)cc1C(C)C.Cc1cc(F)c(/N=N/c2cccc(C(=O)O)c2)cc1C(C)C.Cc1ccc(C(C)C)cc1/N=N/c1ccc(O)c(C(=O)O)c1
InChIInChI=1S/C26H23F3N4OS.4C25H19F5N4S.C24H22F3N5S.C17H17FN2O3.C17H17FN2O2.2C17H16N2O4.C17H18N2O3.C16H14F2N2O3.C16H14F2N2O2.3C16H15FN2O3.2C16H15FN2O2/c1-16(2)19-6-17(11-30-13-19)8-23(34)9-18-7-20(14-31-12-18)24-15-35-25(33-24)32-22-5-3-4-21(10-22)26(27,28)29;2*1-14(2)15-6-8-19(26)21(10-15)33-34-22-11-16(7-9-20(22)27)23-13-35-24(32-23)31-18-5-3-4-17(12-18)25(28,29)30;2*1-14(2)19-11-17(6-8-21(19)26)33-34-18-7-9-22(27)20(12-18)23-13-35-24(32-23)31-16-5-3-4-15(10-16)25(28,29)30;1-15(2)17-8-20(12-28-10-17)31-32-21-9-18(11-29-13-21)22-14-33-23(30-22)7-16-4-3-5-19(6-16)24(25,26)27;1-9(2)12-8-15(14(18)6-10(12)3)20-19-11-4-5-16(21)13(7-11)17(22)23;1-10(2)14-9-16(15(18)7-11(14)3)20-19-13-6-4-5-12(8-13)17(21)22;2*1-10(2)11-4-3-5-14(7-11)18-19-15-8-12(16(20)21)6-13(9-15)17(22)23;1-10(2)12-5-4-11(3)15(8-12)19-18-13-6-7-16(20)14(9-13)17(21)22;1-8(2)10-6-14(13(18)7-12(10)17)20-19-9-3-4-15(21)11(5-9)16(22)23;1-9(2)12-7-15(14(18)8-13(12)17)20-19-11-5-3-4-10(6-11)16(21)22;2*1-9(2)12-7-10(3-5-14(12)17)18-19-11-4-6-15(20)13(8-11)16(21)22;1-9(2)10-3-5-13(17)14(7-10)19-18-11-4-6-15(20)12(8-11)16(21)22;2*1-10(2)11-6-7-14(17)15(9-11)19-18-13-5-3-4-12(8-13)16(20)21/h3-7,10-16H,8-9H2,1-2H3,(H,32,33);4*3-14H,1-2H3,(H,31,32);3-6,8-15,31-32H,7H2,1-2H3;4-9,21H,1-3H3,(H,22,23);4-10H,1-3H3,(H,21,22);2*3-10H,1-2H3,(H,20,21)(H,22,23);4-10,20H,1-3H3,(H,21,22);3-8,21H,1-2H3,(H,22,23);3-9H,1-2H3,(H,21,22);3*3-9,20H,1-2H3,(H,21,22);2*3-10H,1-2H3,(H,20,21)/b;4*34-33+;;2*20-19+;3*19-18+;2*20-19+;5*19-18+
InChIKeyBMEQJZDYKPICKC-MELQDNAYSA-N
MW6619.92 g/mol
LogP110.34
Rot. Bonds89

About 3-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(4-[2-fluoro-5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);bis(4-[4-fluoro-3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);3-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid);5-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid);2-hydroxy-5-[(2-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;bis(5-[(3-propan-2-ylphenyl)diazenyl]benzene-1,3-dicarboxylic acid);1-(5-propan-2-yl-3-pyridinyl)-3-[5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]-3-pyridinyl]propan-2-one;1-(5-propan-2-yl-3-pyridinyl)-2-[5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-3-pyridinyl]hydrazine

3-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(4-[2-fluoro-5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);bis(4-[4-fluoro-3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);3-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid);5-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid);2-hydroxy-5-[(2-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;bis(5-[(3-propan-2-ylphenyl)diazenyl]benzene-1,3-dicarboxylic acid);1-(5-propan-2-yl-3-pyridinyl)-3-[5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]-3-pyridinyl]propan-2-one;1-(5-propan-2-yl-3-pyridinyl)-2-[5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-3-pyridinyl]hydrazine (PubChem CID 157392684) has the molecular formula C347H308F37N49O35S6 and a molecular weight of 6619.92 g/mol. Its IUPAC name is 3-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(4-[2-fluoro-5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);bis(4-[4-fluoro-3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);3-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid);5-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid);2-hydroxy-5-[(2-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;bis(5-[(3-propan-2-ylphenyl)diazenyl]benzene-1,3-dicarboxylic acid);1-(5-propan-2-yl-3-pyridinyl)-3-[5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]-3-pyridinyl]propan-2-one;1-(5-propan-2-yl-3-pyridinyl)-2-[5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-3-pyridinyl]hydrazine.

Molecular Properties

Compound Name3-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(4-[2-fluoro-5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);bis(4-[4-fluoro-3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);3-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid);5-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid);2-hydroxy-5-[(2-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;bis(5-[(3-propan-2-ylphenyl)diazenyl]benzene-1,3-dicarboxylic acid);1-(5-propan-2-yl-3-pyridinyl)-3-[5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]-3-pyridinyl]propan-2-one;1-(5-propan-2-yl-3-pyridinyl)-2-[5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-3-pyridinyl]hydrazine
PubChem CID157392684
Molecular FormulaC347H308F37N49O35S6
Molecular Weight6619.92 g/mol
Exact Mass6615.16
IUPAC Name3-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(4-[2-fluoro-5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);bis(4-[4-fluoro-3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);3-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid);5-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid);2-hydroxy-5-[(2-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;bis(5-[(3-propan-2-ylphenyl)diazenyl]benzene-1,3-dicarboxylic acid);1-(5-propan-2-yl-3-pyridinyl)-3-[5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]-3-pyridinyl]propan-2-one;1-(5-propan-2-yl-3-pyridinyl)-2-[5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-3-pyridinyl]hydrazine
SMILESCC(C)c1cc(/N=N/c2ccc(F)c(-c3csc(Nc4cccc(C(F)(F)F)c4)n3)c2)ccc1F.CC(C)c1cc(/N=N/c2ccc(F)c(-c3csc(Nc4cccc(C(F)(F)F)c4)n3)c2)ccc1F.CC(C)c1cc(/N=N/c2ccc(O)c(C(=O)O)c2)c(F)cc1F.CC(C)c1cc(/N=N/c2ccc(O)c(C(=O)O)c2)ccc1F.CC(C)c1cc(/N=N/c2ccc(O)c(C(=O)O)c2)ccc1F.CC(C)c1cc(/N=N/c2cccc(C(=O)O)c2)c(F)cc1F.CC(C)c1ccc(F)c(/N=N/c2cc(-c3csc(Nc4cccc(C(F)(F)F)c4)n3)ccc2F)c1.CC(C)c1ccc(F)c(/N=N/c2cc(-c3csc(Nc4cccc(C(F)(F)F)c4)n3)ccc2F)c1.CC(C)c1ccc(F)c(/N=N/c2ccc(O)c(C(=O)O)c2)c1.CC(C)c1ccc(F)c(/N=N/c2cccc(C(=O)O)c2)c1.CC(C)c1ccc(F)c(/N=N/c2cccc(C(=O)O)c2)c1.CC(C)c1cccc(/N=N/c2cc(C(=O)O)cc(C(=O)O)c2)c1.CC(C)c1cccc(/N=N/c2cc(C(=O)O)cc(C(=O)O)c2)c1.CC(C)c1cncc(CC(=O)Cc2cncc(-c3csc(Nc4cccc(C(F)(F)F)c4)n3)c2)c1.CC(C)c1cncc(NNc2cncc(-c3csc(Cc4cccc(C(F)(F)F)c4)n3)c2)c1.Cc1cc(F)c(/N=N/c2ccc(O)c(C(=O)O)c2)cc1C(C)C.Cc1cc(F)c(/N=N/c2cccc(C(=O)O)c2)cc1C(C)C.Cc1ccc(C(C)C)cc1/N=N/c1ccc(O)c(C(=O)O)c1
InChIInChI=1S/C26H23F3N4OS.4C25H19F5N4S.C24H22F3N5S.C17H17FN2O3.C17H17FN2O2.2C17H16N2O4.C17H18N2O3.C16H14F2N2O3.C16H14F2N2O2.3C16H15FN2O3.2C16H15FN2O2/c1-16(2)19-6-17(11-30-13-19)8-23(34)9-18-7-20(14-31-12-18)24-15-35-25(33-24)32-22-5-3-4-21(10-22)26(27,28)29;2*1-14(2)15-6-8-19(26)21(10-15)33-34-22-11-16(7-9-20(22)27)23-13-35-24(32-23)31-18-5-3-4-17(12-18)25(28,29)30;2*1-14(2)19-11-17(6-8-21(19)26)33-34-18-7-9-22(27)20(12-18)23-13-35-24(32-23)31-16-5-3-4-15(10-16)25(28,29)30;1-15(2)17-8-20(12-28-10-17)31-32-21-9-18(11-29-13-21)22-14-33-23(30-22)7-16-4-3-5-19(6-16)24(25,26)27;1-9(2)12-8-15(14(18)6-10(12)3)20-19-11-4-5-16(21)13(7-11)17(22)23;1-10(2)14-9-16(15(18)7-11(14)3)20-19-13-6-4-5-12(8-13)17(21)22;2*1-10(2)11-4-3-5-14(7-11)18-19-15-8-12(16(20)21)6-13(9-15)17(22)23;1-10(2)12-5-4-11(3)15(8-12)19-18-13-6-7-16(20)14(9-13)17(21)22;1-8(2)10-6-14(13(18)7-12(10)17)20-19-9-3-4-15(21)11(5-9)16(22)23;1-9(2)12-7-15(14(18)8-13(12)17)20-19-11-5-3-4-10(6-11)16(21)22;2*1-9(2)12-7-10(3-5-14(12)17)18-19-11-4-6-15(20)13(8-11)16(21)22;1-9(2)10-3-5-13(17)14(7-10)19-18-11-4-6-15(20)12(8-11)16(21)22;2*1-10(2)11-6-7-14(17)15(9-11)19-18-13-5-3-4-12(8-13)16(20)21/h3-7,10-16H,8-9H2,1-2H3,(H,32,33);4*3-14H,1-2H3,(H,31,32);3-6,8-15,31-32H,7H2,1-2H3;4-9,21H,1-3H3,(H,22,23);4-10H,1-3H3,(H,21,22);2*3-10H,1-2H3,(H,20,21)(H,22,23);4-10,20H,1-3H3,(H,21,22);3-8,21H,1-2H3,(H,22,23);3-9H,1-2H3,(H,21,22);3*3-9,20H,1-2H3,(H,21,22);2*3-10H,1-2H3,(H,20,21)/b;4*34-33+;;2*20-19+;3*19-18+;2*20-19+;5*19-18+
InChIKeyBMEQJZDYKPICKC-MELQDNAYSA-N
XLogP110.34
TPSA1269.28 Ų
H-Bond Donors27
H-Bond Acceptors76
Rotatable Bonds89
Heavy Atoms474
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5006619.92
LogP ≤ 5110.34
H-Bond Donors ≤ 527
H-Bond Acceptors ≤ 1076

Analyze 3-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(4-[2-fluoro-5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);bis(4-[4-fluoro-3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);3-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid);5-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid);2-hydroxy-5-[(2-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;bis(5-[(3-propan-2-ylphenyl)diazenyl]benzene-1,3-dicarboxylic acid);1-(5-propan-2-yl-3-pyridinyl)-3-[5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]-3-pyridinyl]propan-2-one;1-(5-propan-2-yl-3-pyridinyl)-2-[5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-3-pyridinyl]hydrazine with MolForge

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What is the IUPAC name of 3-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(4-[2-fluoro-5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);bis(4-[4-fluoro-3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);3-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid);5-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid);2-hydroxy-5-[(2-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;bis(5-[(3-propan-2-ylphenyl)diazenyl]benzene-1,3-dicarboxylic acid);1-(5-propan-2-yl-3-pyridinyl)-3-[5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]-3-pyridinyl]propan-2-one;1-(5-propan-2-yl-3-pyridinyl)-2-[5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-3-pyridinyl]hydrazine?
The IUPAC name of 3-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(4-[2-fluoro-5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);bis(4-[4-fluoro-3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);3-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid);5-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid);2-hydroxy-5-[(2-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;bis(5-[(3-propan-2-ylphenyl)diazenyl]benzene-1,3-dicarboxylic acid);1-(5-propan-2-yl-3-pyridinyl)-3-[5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]-3-pyridinyl]propan-2-one;1-(5-propan-2-yl-3-pyridinyl)-2-[5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-3-pyridinyl]hydrazine (CID 157392684) is 3-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(4-[2-fluoro-5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);bis(4-[4-fluoro-3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);3-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid);5-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid);2-hydroxy-5-[(2-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;bis(5-[(3-propan-2-ylphenyl)diazenyl]benzene-1,3-dicarboxylic acid);1-(5-propan-2-yl-3-pyridinyl)-3-[5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]-3-pyridinyl]propan-2-one;1-(5-propan-2-yl-3-pyridinyl)-2-[5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-3-pyridinyl]hydrazine.
What is the SMILES notation for 3-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(4-[2-fluoro-5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);bis(4-[4-fluoro-3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);3-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid);5-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid);2-hydroxy-5-[(2-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;bis(5-[(3-propan-2-ylphenyl)diazenyl]benzene-1,3-dicarboxylic acid);1-(5-propan-2-yl-3-pyridinyl)-3-[5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]-3-pyridinyl]propan-2-one;1-(5-propan-2-yl-3-pyridinyl)-2-[5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-3-pyridinyl]hydrazine?
The canonical SMILES for 3-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(4-[2-fluoro-5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);bis(4-[4-fluoro-3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);3-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid);5-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid);2-hydroxy-5-[(2-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;bis(5-[(3-propan-2-ylphenyl)diazenyl]benzene-1,3-dicarboxylic acid);1-(5-propan-2-yl-3-pyridinyl)-3-[5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]-3-pyridinyl]propan-2-one;1-(5-propan-2-yl-3-pyridinyl)-2-[5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-3-pyridinyl]hydrazine is CC(C)c1cc(/N=N/c2ccc(F)c(-c3csc(Nc4cccc(C(F)(F)F)c4)n3)c2)ccc1F.CC(C)c1cc(/N=N/c2ccc(F)c(-c3csc(Nc4cccc(C(F)(F)F)c4)n3)c2)ccc1F.CC(C)c1cc(/N=N/c2ccc(O)c(C(=O)O)c2)c(F)cc1F.CC(C)c1cc(/N=N/c2ccc(O)c(C(=O)O)c2)ccc1F.CC(C)c1cc(/N=N/c2ccc(O)c(C(=O)O)c2)ccc1F.CC(C)c1cc(/N=N/c2cccc(C(=O)O)c2)c(F)cc1F.CC(C)c1ccc(F)c(/N=N/c2cc(-c3csc(Nc4cccc(C(F)(F)F)c4)n3)ccc2F)c1.CC(C)c1ccc(F)c(/N=N/c2cc(-c3csc(Nc4cccc(C(F)(F)F)c4)n3)ccc2F)c1.CC(C)c1ccc(F)c(/N=N/c2ccc(O)c(C(=O)O)c2)c1.CC(C)c1ccc(F)c(/N=N/c2cccc(C(=O)O)c2)c1.CC(C)c1ccc(F)c(/N=N/c2cccc(C(=O)O)c2)c1.CC(C)c1cccc(/N=N/c2cc(C(=O)O)cc(C(=O)O)c2)c1.CC(C)c1cccc(/N=N/c2cc(C(=O)O)cc(C(=O)O)c2)c1.CC(C)c1cncc(CC(=O)Cc2cncc(-c3csc(Nc4cccc(C(F)(F)F)c4)n3)c2)c1.CC(C)c1cncc(NNc2cncc(-c3csc(Cc4cccc(C(F)(F)F)c4)n3)c2)c1.Cc1cc(F)c(/N=N/c2ccc(O)c(C(=O)O)c2)cc1C(C)C.Cc1cc(F)c(/N=N/c2cccc(C(=O)O)c2)cc1C(C)C.Cc1ccc(C(C)C)cc1/N=N/c1ccc(O)c(C(=O)O)c1.
What is the InChIKey of 3-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(4-[2-fluoro-5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);bis(4-[4-fluoro-3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);3-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid);5-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid);2-hydroxy-5-[(2-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;bis(5-[(3-propan-2-ylphenyl)diazenyl]benzene-1,3-dicarboxylic acid);1-(5-propan-2-yl-3-pyridinyl)-3-[5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]-3-pyridinyl]propan-2-one;1-(5-propan-2-yl-3-pyridinyl)-2-[5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-3-pyridinyl]hydrazine?
The InChIKey is BMEQJZDYKPICKC-MELQDNAYSA-N. The full InChI is InChI=1S/C26H23F3N4OS.4C25H19F5N4S.C24H22F3N5S.C17H17FN2O3.C17H17FN2O2.2C17H16N2O4.C17H18N2O3.C16H14F2N2O3.C16H14F2N2O2.3C16H15FN2O3.2C16H15FN2O2/c1-16(2)19-6-17(11-30-13-19)8-23(34)9-18-7-20(14-31-12-18)24-15-35-25(33-24)32-22-5-3-4-21(10-22)26(27,28)29;2*1-14(2)15-6-8-19(26)21(10-15)33-34-22-11-16(7-9-20(22)27)23-13-35-24(32-23)31-18-5-3-4-17(12-18)25(28,29)30;2*1-14(2)19-11-17(6-8-21(19)26)33-34-18-7-9-22(27)20(12-18)23-13-35-24(32-23)31-16-5-3-4-15(10-16)25(28,29)30;1-15(2)17-8-20(12-28-10-17)31-32-21-9-18(11-29-13-21)22-14-33-23(30-22)7-16-4-3-5-19(6-16)24(25,26)27;1-9(2)12-8-15(14(18)6-10(12)3)20-19-11-4-5-16(21)13(7-11)17(22)23;1-10(2)14-9-16(15(18)7-11(14)3)20-19-13-6-4-5-12(8-13)17(21)22;2*1-10(2)11-4-3-5-14(7-11)18-19-15-8-12(16(20)21)6-13(9-15)17(22)23;1-10(2)12-5-4-11(3)15(8-12)19-18-13-6-7-16(20)14(9-13)17(21)22;1-8(2)10-6-14(13(18)7-12(10)17)20-19-9-3-4-15(21)11(5-9)16(22)23;1-9(2)12-7-15(14(18)8-13(12)17)20-19-11-5-3-4-10(6-11)16(21)22;2*1-9(2)12-7-10(3-5-14(12)17)18-19-11-4-6-15(20)13(8-11)16(21)22;1-9(2)10-3-5-13(17)14(7-10)19-18-11-4-6-15(20)12(8-11)16(21)22;2*1-10(2)11-6-7-14(17)15(9-11)19-18-13-5-3-4-12(8-13)16(20)21/h3-7,10-16H,8-9H2,1-2H3,(H,32,33);4*3-14H,1-2H3,(H,31,32);3-6,8-15,31-32H,7H2,1-2H3;4-9,21H,1-3H3,(H,22,23);4-10H,1-3H3,(H,21,22);2*3-10H,1-2H3,(H,20,21)(H,22,23);4-10,20H,1-3H3,(H,21,22);3-8,21H,1-2H3,(H,22,23);3-9H,1-2H3,(H,21,22);3*3-9,20H,1-2H3,(H,21,22);2*3-10H,1-2H3,(H,20,21)/b;4*34-33+;;2*20-19+;3*19-18+;2*20-19+;5*19-18+.
What are the key properties of 3-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(4-[2-fluoro-5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);bis(4-[4-fluoro-3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);3-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid);5-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid);2-hydroxy-5-[(2-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;bis(5-[(3-propan-2-ylphenyl)diazenyl]benzene-1,3-dicarboxylic acid);1-(5-propan-2-yl-3-pyridinyl)-3-[5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]-3-pyridinyl]propan-2-one;1-(5-propan-2-yl-3-pyridinyl)-2-[5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-3-pyridinyl]hydrazine?
3-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(4-[2-fluoro-5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);bis(4-[4-fluoro-3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);3-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid);5-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid);2-hydroxy-5-[(2-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;bis(5-[(3-propan-2-ylphenyl)diazenyl]benzene-1,3-dicarboxylic acid);1-(5-propan-2-yl-3-pyridinyl)-3-[5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]-3-pyridinyl]propan-2-one;1-(5-propan-2-yl-3-pyridinyl)-2-[5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-3-pyridinyl]hydrazine has a molecular weight of 6619.92 g/mol, XLogP of 110.34, 89 rotatable bonds, 27 hydrogen bond donors, and 76 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2,4-difluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(4-[2-fluoro-5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);bis(4-[4-fluoro-3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine);3-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;5-[(2-fluoro-4-methyl-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(3-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]benzoic acid);5-[(2-fluoro-5-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid;bis(5-[(4-fluoro-3-propan-2-ylphenyl)diazenyl]-2-hydroxybenzoic acid);2-hydroxy-5-[(2-methyl-5-propan-2-ylphenyl)diazenyl]benzoic acid;bis(5-[(3-propan-2-ylphenyl)diazenyl]benzene-1,3-dicarboxylic acid);1-(5-propan-2-yl-3-pyridinyl)-3-[5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]-3-pyridinyl]propan-2-one;1-(5-propan-2-yl-3-pyridinyl)-2-[5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-3-pyridinyl]hydrazine is sourced from PubChem (CID 157392684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).