N-[3-[2-(difluoromethoxy)-5-(difluoromethylsulfanyl)phenyl]-1-[2-(4-morpholin-4-ylpiperidin-1-yl)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-[1-[(2S)-2-hydroxypropyl]pyrazol-4-yl]sulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(methylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3R)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3S)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methyl 4-[[1-[2-[3-[2-(difluoromethoxy)-5-(1,3-difluoropropan-2-ylsulfanyl)phenyl]-4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)pyrazol-1-yl]acetyl]piperidin-4-yl]methyl]piperazine-1-carboxylate;methyl 2-[4-(difluoromethoxy)-3-[4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)-1H-pyrazol-5-yl]phenyl]sulfanylacetate

C239H242F22N72O34S9 — CID 157244633

IUPACN-[3-[2-(difluoromethoxy)-5-(difluoromethylsulfanyl)phenyl]-1-[2-(4-morpholin-4-ylpiperidin-1-yl)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-[1-[(2S)-2-hydroxypropyl]pyrazol-4-yl]sulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(methylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3R)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3S)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methyl 4-[[1-[2-[3-[2-(difluoromethoxy)-5-(1,3-difluoropropan-2-ylsulfanyl)phenyl]-4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)pyrazol-1-yl]acetyl]piperidin-4-yl]methyl]piperazine-1-carboxylate;methyl 2-[4-(difluoromethoxy)-3-[4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)-1H-pyrazol-5-yl]phenyl]sulfanylacetate
SMILESCNC(=O)Cn1cc(NC(=O)c2cnn3cccnc23)c(-c2cc(SC)ccc2OC(F)F)n1.COC(=O)CSc1ccc(OC(F)F)c(-c2[nH]ncc2NC(=O)c2cnn3cccnc23)c1.COC(=O)N1CCN(CC2CCN(C(=O)Cn3cc(NC(=O)c4cnn5cccnc45)c(-c4cc(SC(CF)CF)ccc4OC(F)F)n3)CC2)CC1.CSc1ccc(OC(F)F)c(-c2nn(CC(=O)N(C)C)cc2NC(=O)c2cnn3cccnc23)c1.CSc1ccc(OC(F)F)c(-c2nn(CC(C)(C)O)cc2NC(=O)c2cnn3cccnc23)c1.C[C@H](O)Cn1cc(Sc2ccc(OC(F)F)c(-c3nn(CC(=O)N(C)C)cc3NC(=O)c3cnn4cccnc34)c2)cn1.O=C(Nc1cn(CC(=O)N2CCC(N3CCOCC3)CC2)nc1-c1cc(SC(F)F)ccc1OC(F)F)c1cnn2cccnc12.O=C(Nc1cn(Cc2cn(C3CCN([C@@H]4CCOC4)CC3)nn2)nc1-c1cc(SC2COC2)ccc1OC(F)F)c1cnn2cccnc12.O=C(Nc1cn(Cc2cn(C3CCN([C@H]4CCOC4)CC3)nn2)nc1-c1cc(SC2COC2)ccc1OC(F)F)c1cnn2cccnc12
InChIInChI=1S/C34H39F4N9O5S.2C32H34F2N10O4S.C29H30F4N8O4S.C27H27F2N9O4S.C22H21F2N7O3S.C22H22F2N6O3S.C21H19F2N7O3S.C20H16F2N6O4S/c1-51-34(50)45-13-11-43(12-14-45)19-22-5-9-44(10-6-22)29(48)21-46-20-27(41-32(49)26-18-40-47-8-2-7-39-31(26)47)30(42-46)25-15-23(53-24(16-35)17-36)3-4-28(25)52-33(37)38;2*33-32(34)48-28-3-2-23(49-24-18-47-19-24)12-25(28)29-27(37-31(45)26-13-36-43-8-1-7-35-30(26)43)16-42(39-29)14-20-15-44(40-38-20)21-4-9-41(10-5-21)22-6-11-46-17-22;30-28(31)45-23-3-2-19(46-29(32)33)14-20(23)25-22(36-27(43)21-15-35-41-7-1-6-34-26(21)41)16-40(37-25)17-24(42)39-8-4-18(5-9-39)38-10-12-44-13-11-38;1-16(39)12-36-13-18(10-31-36)43-17-5-6-22(42-27(28)29)19(9-17)24-21(14-37(34-24)15-23(40)35(2)3)33-26(41)20-11-32-38-8-4-7-30-25(20)38;1-29(2)18(32)12-30-11-16(27-21(33)15-10-26-31-8-4-7-25-20(15)31)19(28-30)14-9-13(35-3)5-6-17(14)34-22(23)24;1-22(2,32)12-29-11-16(27-20(31)15-10-26-30-8-4-7-25-19(15)30)18(28-29)14-9-13(34-3)5-6-17(14)33-21(23)24;1-24-17(31)11-29-10-15(27-20(32)14-9-26-30-7-3-6-25-19(14)30)18(28-29)13-8-12(34-2)4-5-16(13)33-21(22)23;1-31-16(29)10-33-11-3-4-15(32-20(21)22)12(7-11)17-14(9-24-27-17)26-19(30)13-8-25-28-6-2-5-23-18(13)28/h2-4,7-8,15,18,20,22,24,33H,5-6,9-14,16-17,19,21H2,1H3,(H,41,49);2*1-3,7-8,12-13,15-16,21-22,24,32H,4-6,9-11,14,17-19H2,(H,37,45);1-3,6-7,14-16,18,28-29H,4-5,8-13,17H2,(H,36,43);4-11,13-14,16,27,39H,12,15H2,1-3H3,(H,33,41);4-11,22H,12H2,1-3H3,(H,27,33);4-11,21,32H,12H2,1-3H3,(H,27,31);3-10,21H,11H2,1-2H3,(H,24,31)(H,27,32);2-9,20H,10H2,1H3,(H,24,27)(H,26,30)/t;2*22-;;16-;;;;/m.10.0..../s1
InChIKeyAVPNKGICEOENHA-YMSVLQIWSA-N
MW5373.59 g/mol
LogP33.17
Rot. Bonds88

About N-[3-[2-(difluoromethoxy)-5-(difluoromethylsulfanyl)phenyl]-1-[2-(4-morpholin-4-ylpiperidin-1-yl)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-[1-[(2S)-2-hydroxypropyl]pyrazol-4-yl]sulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(methylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3R)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3S)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methyl 4-[[1-[2-[3-[2-(difluoromethoxy)-5-(1,3-difluoropropan-2-ylsulfanyl)phenyl]-4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)pyrazol-1-yl]acetyl]piperidin-4-yl]methyl]piperazine-1-carboxylate;methyl 2-[4-(difluoromethoxy)-3-[4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)-1H-pyrazol-5-yl]phenyl]sulfanylacetate

N-[3-[2-(difluoromethoxy)-5-(difluoromethylsulfanyl)phenyl]-1-[2-(4-morpholin-4-ylpiperidin-1-yl)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-[1-[(2S)-2-hydroxypropyl]pyrazol-4-yl]sulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(methylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3R)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3S)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methyl 4-[[1-[2-[3-[2-(difluoromethoxy)-5-(1,3-difluoropropan-2-ylsulfanyl)phenyl]-4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)pyrazol-1-yl]acetyl]piperidin-4-yl]methyl]piperazine-1-carboxylate;methyl 2-[4-(difluoromethoxy)-3-[4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)-1H-pyrazol-5-yl]phenyl]sulfanylacetate (PubChem CID 157244633) has the molecular formula C239H242F22N72O34S9 and a molecular weight of 5373.59 g/mol. Its IUPAC name is N-[3-[2-(difluoromethoxy)-5-(difluoromethylsulfanyl)phenyl]-1-[2-(4-morpholin-4-ylpiperidin-1-yl)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-[1-[(2S)-2-hydroxypropyl]pyrazol-4-yl]sulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(methylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3R)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3S)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methyl 4-[[1-[2-[3-[2-(difluoromethoxy)-5-(1,3-difluoropropan-2-ylsulfanyl)phenyl]-4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)pyrazol-1-yl]acetyl]piperidin-4-yl]methyl]piperazine-1-carboxylate;methyl 2-[4-(difluoromethoxy)-3-[4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)-1H-pyrazol-5-yl]phenyl]sulfanylacetate.

Molecular Properties

Compound NameN-[3-[2-(difluoromethoxy)-5-(difluoromethylsulfanyl)phenyl]-1-[2-(4-morpholin-4-ylpiperidin-1-yl)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-[1-[(2S)-2-hydroxypropyl]pyrazol-4-yl]sulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(methylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3R)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3S)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methyl 4-[[1-[2-[3-[2-(difluoromethoxy)-5-(1,3-difluoropropan-2-ylsulfanyl)phenyl]-4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)pyrazol-1-yl]acetyl]piperidin-4-yl]methyl]piperazine-1-carboxylate;methyl 2-[4-(difluoromethoxy)-3-[4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)-1H-pyrazol-5-yl]phenyl]sulfanylacetate
PubChem CID157244633
Molecular FormulaC239H242F22N72O34S9
Molecular Weight5373.59 g/mol
Exact Mass5369.66
IUPAC NameN-[3-[2-(difluoromethoxy)-5-(difluoromethylsulfanyl)phenyl]-1-[2-(4-morpholin-4-ylpiperidin-1-yl)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-[1-[(2S)-2-hydroxypropyl]pyrazol-4-yl]sulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(methylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3R)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3S)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methyl 4-[[1-[2-[3-[2-(difluoromethoxy)-5-(1,3-difluoropropan-2-ylsulfanyl)phenyl]-4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)pyrazol-1-yl]acetyl]piperidin-4-yl]methyl]piperazine-1-carboxylate;methyl 2-[4-(difluoromethoxy)-3-[4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)-1H-pyrazol-5-yl]phenyl]sulfanylacetate
SMILESCNC(=O)Cn1cc(NC(=O)c2cnn3cccnc23)c(-c2cc(SC)ccc2OC(F)F)n1.COC(=O)CSc1ccc(OC(F)F)c(-c2[nH]ncc2NC(=O)c2cnn3cccnc23)c1.COC(=O)N1CCN(CC2CCN(C(=O)Cn3cc(NC(=O)c4cnn5cccnc45)c(-c4cc(SC(CF)CF)ccc4OC(F)F)n3)CC2)CC1.CSc1ccc(OC(F)F)c(-c2nn(CC(=O)N(C)C)cc2NC(=O)c2cnn3cccnc23)c1.CSc1ccc(OC(F)F)c(-c2nn(CC(C)(C)O)cc2NC(=O)c2cnn3cccnc23)c1.C[C@H](O)Cn1cc(Sc2ccc(OC(F)F)c(-c3nn(CC(=O)N(C)C)cc3NC(=O)c3cnn4cccnc34)c2)cn1.O=C(Nc1cn(CC(=O)N2CCC(N3CCOCC3)CC2)nc1-c1cc(SC(F)F)ccc1OC(F)F)c1cnn2cccnc12.O=C(Nc1cn(Cc2cn(C3CCN([C@@H]4CCOC4)CC3)nn2)nc1-c1cc(SC2COC2)ccc1OC(F)F)c1cnn2cccnc12.O=C(Nc1cn(Cc2cn(C3CCN([C@H]4CCOC4)CC3)nn2)nc1-c1cc(SC2COC2)ccc1OC(F)F)c1cnn2cccnc12
InChIInChI=1S/C34H39F4N9O5S.2C32H34F2N10O4S.C29H30F4N8O4S.C27H27F2N9O4S.C22H21F2N7O3S.C22H22F2N6O3S.C21H19F2N7O3S.C20H16F2N6O4S/c1-51-34(50)45-13-11-43(12-14-45)19-22-5-9-44(10-6-22)29(48)21-46-20-27(41-32(49)26-18-40-47-8-2-7-39-31(26)47)30(42-46)25-15-23(53-24(16-35)17-36)3-4-28(25)52-33(37)38;2*33-32(34)48-28-3-2-23(49-24-18-47-19-24)12-25(28)29-27(37-31(45)26-13-36-43-8-1-7-35-30(26)43)16-42(39-29)14-20-15-44(40-38-20)21-4-9-41(10-5-21)22-6-11-46-17-22;30-28(31)45-23-3-2-19(46-29(32)33)14-20(23)25-22(36-27(43)21-15-35-41-7-1-6-34-26(21)41)16-40(37-25)17-24(42)39-8-4-18(5-9-39)38-10-12-44-13-11-38;1-16(39)12-36-13-18(10-31-36)43-17-5-6-22(42-27(28)29)19(9-17)24-21(14-37(34-24)15-23(40)35(2)3)33-26(41)20-11-32-38-8-4-7-30-25(20)38;1-29(2)18(32)12-30-11-16(27-21(33)15-10-26-31-8-4-7-25-20(15)31)19(28-30)14-9-13(35-3)5-6-17(14)34-22(23)24;1-22(2,32)12-29-11-16(27-20(31)15-10-26-30-8-4-7-25-19(15)30)18(28-29)14-9-13(34-3)5-6-17(14)33-21(23)24;1-24-17(31)11-29-10-15(27-20(32)14-9-26-30-7-3-6-25-19(14)30)18(28-29)13-8-12(34-2)4-5-16(13)33-21(22)23;1-31-16(29)10-33-11-3-4-15(32-20(21)22)12(7-11)17-14(9-24-27-17)26-19(30)13-8-25-28-6-2-5-23-18(13)28/h2-4,7-8,15,18,20,22,24,33H,5-6,9-14,16-17,19,21H2,1H3,(H,41,49);2*1-3,7-8,12-13,15-16,21-22,24,32H,4-6,9-11,14,17-19H2,(H,37,45);1-3,6-7,14-16,18,28-29H,4-5,8-13,17H2,(H,36,43);4-11,13-14,16,27,39H,12,15H2,1-3H3,(H,33,41);4-11,22H,12H2,1-3H3,(H,27,33);4-11,21,32H,12H2,1-3H3,(H,27,31);3-10,21H,11H2,1-2H3,(H,24,31)(H,27,32);2-9,20H,10H2,1H3,(H,24,27)(H,26,30)/t;2*22-;;16-;;;;/m.10.0..../s1
InChIKeyAVPNKGICEOENHA-YMSVLQIWSA-N
XLogP33.17
TPSA1132.91 Ų
H-Bond Donors13
H-Bond Acceptors99
Rotatable Bonds88
Heavy Atoms376
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005373.59
LogP ≤ 533.17
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1099

Analyze N-[3-[2-(difluoromethoxy)-5-(difluoromethylsulfanyl)phenyl]-1-[2-(4-morpholin-4-ylpiperidin-1-yl)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-[1-[(2S)-2-hydroxypropyl]pyrazol-4-yl]sulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(methylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3R)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3S)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methyl 4-[[1-[2-[3-[2-(difluoromethoxy)-5-(1,3-difluoropropan-2-ylsulfanyl)phenyl]-4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)pyrazol-1-yl]acetyl]piperidin-4-yl]methyl]piperazine-1-carboxylate;methyl 2-[4-(difluoromethoxy)-3-[4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)-1H-pyrazol-5-yl]phenyl]sulfanylacetate with MolForge

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What is the IUPAC name of N-[3-[2-(difluoromethoxy)-5-(difluoromethylsulfanyl)phenyl]-1-[2-(4-morpholin-4-ylpiperidin-1-yl)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-[1-[(2S)-2-hydroxypropyl]pyrazol-4-yl]sulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(methylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3R)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3S)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methyl 4-[[1-[2-[3-[2-(difluoromethoxy)-5-(1,3-difluoropropan-2-ylsulfanyl)phenyl]-4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)pyrazol-1-yl]acetyl]piperidin-4-yl]methyl]piperazine-1-carboxylate;methyl 2-[4-(difluoromethoxy)-3-[4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)-1H-pyrazol-5-yl]phenyl]sulfanylacetate?
The IUPAC name of N-[3-[2-(difluoromethoxy)-5-(difluoromethylsulfanyl)phenyl]-1-[2-(4-morpholin-4-ylpiperidin-1-yl)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-[1-[(2S)-2-hydroxypropyl]pyrazol-4-yl]sulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(methylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3R)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3S)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methyl 4-[[1-[2-[3-[2-(difluoromethoxy)-5-(1,3-difluoropropan-2-ylsulfanyl)phenyl]-4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)pyrazol-1-yl]acetyl]piperidin-4-yl]methyl]piperazine-1-carboxylate;methyl 2-[4-(difluoromethoxy)-3-[4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)-1H-pyrazol-5-yl]phenyl]sulfanylacetate (CID 157244633) is N-[3-[2-(difluoromethoxy)-5-(difluoromethylsulfanyl)phenyl]-1-[2-(4-morpholin-4-ylpiperidin-1-yl)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-[1-[(2S)-2-hydroxypropyl]pyrazol-4-yl]sulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(methylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3R)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3S)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methyl 4-[[1-[2-[3-[2-(difluoromethoxy)-5-(1,3-difluoropropan-2-ylsulfanyl)phenyl]-4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)pyrazol-1-yl]acetyl]piperidin-4-yl]methyl]piperazine-1-carboxylate;methyl 2-[4-(difluoromethoxy)-3-[4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)-1H-pyrazol-5-yl]phenyl]sulfanylacetate.
What is the SMILES notation for N-[3-[2-(difluoromethoxy)-5-(difluoromethylsulfanyl)phenyl]-1-[2-(4-morpholin-4-ylpiperidin-1-yl)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-[1-[(2S)-2-hydroxypropyl]pyrazol-4-yl]sulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(methylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3R)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3S)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methyl 4-[[1-[2-[3-[2-(difluoromethoxy)-5-(1,3-difluoropropan-2-ylsulfanyl)phenyl]-4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)pyrazol-1-yl]acetyl]piperidin-4-yl]methyl]piperazine-1-carboxylate;methyl 2-[4-(difluoromethoxy)-3-[4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)-1H-pyrazol-5-yl]phenyl]sulfanylacetate?
The canonical SMILES for N-[3-[2-(difluoromethoxy)-5-(difluoromethylsulfanyl)phenyl]-1-[2-(4-morpholin-4-ylpiperidin-1-yl)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-[1-[(2S)-2-hydroxypropyl]pyrazol-4-yl]sulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(methylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3R)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3S)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methyl 4-[[1-[2-[3-[2-(difluoromethoxy)-5-(1,3-difluoropropan-2-ylsulfanyl)phenyl]-4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)pyrazol-1-yl]acetyl]piperidin-4-yl]methyl]piperazine-1-carboxylate;methyl 2-[4-(difluoromethoxy)-3-[4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)-1H-pyrazol-5-yl]phenyl]sulfanylacetate is CNC(=O)Cn1cc(NC(=O)c2cnn3cccnc23)c(-c2cc(SC)ccc2OC(F)F)n1.COC(=O)CSc1ccc(OC(F)F)c(-c2[nH]ncc2NC(=O)c2cnn3cccnc23)c1.COC(=O)N1CCN(CC2CCN(C(=O)Cn3cc(NC(=O)c4cnn5cccnc45)c(-c4cc(SC(CF)CF)ccc4OC(F)F)n3)CC2)CC1.CSc1ccc(OC(F)F)c(-c2nn(CC(=O)N(C)C)cc2NC(=O)c2cnn3cccnc23)c1.CSc1ccc(OC(F)F)c(-c2nn(CC(C)(C)O)cc2NC(=O)c2cnn3cccnc23)c1.C[C@H](O)Cn1cc(Sc2ccc(OC(F)F)c(-c3nn(CC(=O)N(C)C)cc3NC(=O)c3cnn4cccnc34)c2)cn1.O=C(Nc1cn(CC(=O)N2CCC(N3CCOCC3)CC2)nc1-c1cc(SC(F)F)ccc1OC(F)F)c1cnn2cccnc12.O=C(Nc1cn(Cc2cn(C3CCN([C@@H]4CCOC4)CC3)nn2)nc1-c1cc(SC2COC2)ccc1OC(F)F)c1cnn2cccnc12.O=C(Nc1cn(Cc2cn(C3CCN([C@H]4CCOC4)CC3)nn2)nc1-c1cc(SC2COC2)ccc1OC(F)F)c1cnn2cccnc12.
What is the InChIKey of N-[3-[2-(difluoromethoxy)-5-(difluoromethylsulfanyl)phenyl]-1-[2-(4-morpholin-4-ylpiperidin-1-yl)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-[1-[(2S)-2-hydroxypropyl]pyrazol-4-yl]sulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(methylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3R)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3S)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methyl 4-[[1-[2-[3-[2-(difluoromethoxy)-5-(1,3-difluoropropan-2-ylsulfanyl)phenyl]-4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)pyrazol-1-yl]acetyl]piperidin-4-yl]methyl]piperazine-1-carboxylate;methyl 2-[4-(difluoromethoxy)-3-[4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)-1H-pyrazol-5-yl]phenyl]sulfanylacetate?
The InChIKey is AVPNKGICEOENHA-YMSVLQIWSA-N. The full InChI is InChI=1S/C34H39F4N9O5S.2C32H34F2N10O4S.C29H30F4N8O4S.C27H27F2N9O4S.C22H21F2N7O3S.C22H22F2N6O3S.C21H19F2N7O3S.C20H16F2N6O4S/c1-51-34(50)45-13-11-43(12-14-45)19-22-5-9-44(10-6-22)29(48)21-46-20-27(41-32(49)26-18-40-47-8-2-7-39-31(26)47)30(42-46)25-15-23(53-24(16-35)17-36)3-4-28(25)52-33(37)38;2*33-32(34)48-28-3-2-23(49-24-18-47-19-24)12-25(28)29-27(37-31(45)26-13-36-43-8-1-7-35-30(26)43)16-42(39-29)14-20-15-44(40-38-20)21-4-9-41(10-5-21)22-6-11-46-17-22;30-28(31)45-23-3-2-19(46-29(32)33)14-20(23)25-22(36-27(43)21-15-35-41-7-1-6-34-26(21)41)16-40(37-25)17-24(42)39-8-4-18(5-9-39)38-10-12-44-13-11-38;1-16(39)12-36-13-18(10-31-36)43-17-5-6-22(42-27(28)29)19(9-17)24-21(14-37(34-24)15-23(40)35(2)3)33-26(41)20-11-32-38-8-4-7-30-25(20)38;1-29(2)18(32)12-30-11-16(27-21(33)15-10-26-31-8-4-7-25-20(15)31)19(28-30)14-9-13(35-3)5-6-17(14)34-22(23)24;1-22(2,32)12-29-11-16(27-20(31)15-10-26-30-8-4-7-25-19(15)30)18(28-29)14-9-13(34-3)5-6-17(14)33-21(23)24;1-24-17(31)11-29-10-15(27-20(32)14-9-26-30-7-3-6-25-19(14)30)18(28-29)13-8-12(34-2)4-5-16(13)33-21(22)23;1-31-16(29)10-33-11-3-4-15(32-20(21)22)12(7-11)17-14(9-24-27-17)26-19(30)13-8-25-28-6-2-5-23-18(13)28/h2-4,7-8,15,18,20,22,24,33H,5-6,9-14,16-17,19,21H2,1H3,(H,41,49);2*1-3,7-8,12-13,15-16,21-22,24,32H,4-6,9-11,14,17-19H2,(H,37,45);1-3,6-7,14-16,18,28-29H,4-5,8-13,17H2,(H,36,43);4-11,13-14,16,27,39H,12,15H2,1-3H3,(H,33,41);4-11,22H,12H2,1-3H3,(H,27,33);4-11,21,32H,12H2,1-3H3,(H,27,31);3-10,21H,11H2,1-2H3,(H,24,31)(H,27,32);2-9,20H,10H2,1H3,(H,24,27)(H,26,30)/t;2*22-;;16-;;;;/m.10.0..../s1.
What are the key properties of N-[3-[2-(difluoromethoxy)-5-(difluoromethylsulfanyl)phenyl]-1-[2-(4-morpholin-4-ylpiperidin-1-yl)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-[1-[(2S)-2-hydroxypropyl]pyrazol-4-yl]sulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(methylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3R)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3S)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methyl 4-[[1-[2-[3-[2-(difluoromethoxy)-5-(1,3-difluoropropan-2-ylsulfanyl)phenyl]-4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)pyrazol-1-yl]acetyl]piperidin-4-yl]methyl]piperazine-1-carboxylate;methyl 2-[4-(difluoromethoxy)-3-[4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)-1H-pyrazol-5-yl]phenyl]sulfanylacetate?
N-[3-[2-(difluoromethoxy)-5-(difluoromethylsulfanyl)phenyl]-1-[2-(4-morpholin-4-ylpiperidin-1-yl)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-[1-[(2S)-2-hydroxypropyl]pyrazol-4-yl]sulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(methylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3R)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3S)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methyl 4-[[1-[2-[3-[2-(difluoromethoxy)-5-(1,3-difluoropropan-2-ylsulfanyl)phenyl]-4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)pyrazol-1-yl]acetyl]piperidin-4-yl]methyl]piperazine-1-carboxylate;methyl 2-[4-(difluoromethoxy)-3-[4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)-1H-pyrazol-5-yl]phenyl]sulfanylacetate has a molecular weight of 5373.59 g/mol, XLogP of 33.17, 88 rotatable bonds, 13 hydrogen bond donors, and 99 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-(difluoromethoxy)-5-(difluoromethylsulfanyl)phenyl]-1-[2-(4-morpholin-4-ylpiperidin-1-yl)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-[1-[(2S)-2-hydroxypropyl]pyrazol-4-yl]sulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(methylamino)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3R)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(oxetan-3-ylsulfanyl)phenyl]-1-[[1-[1-[(3S)-oxolan-3-yl]piperidin-4-yl]triazol-4-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methyl 4-[[1-[2-[3-[2-(difluoromethoxy)-5-(1,3-difluoropropan-2-ylsulfanyl)phenyl]-4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)pyrazol-1-yl]acetyl]piperidin-4-yl]methyl]piperazine-1-carboxylate;methyl 2-[4-(difluoromethoxy)-3-[4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)-1H-pyrazol-5-yl]phenyl]sulfanylacetate is sourced from PubChem (CID 157244633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).