6-chloro-3-(ethylsulfonylamino)-2-fluoro-N-(1H-pyrazolo[3,4-b]pyridin-5-yl)benzamide;3-(2,2-difluoroethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propan-2-ylsulfamoylamino)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(pyrrolidin-1-ylsulfonylamino)benzamide;2,6-difluoro-N-(3-propan-2-yloxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propylsulfonylamino)benzamide;3-(dimethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2-fluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-5-(propylsulfonylamino)benzamide

C118H118ClF14N39O27S7 — CID 159568841

IUPAC6-chloro-3-(ethylsulfonylamino)-2-fluoro-N-(1H-pyrazolo[3,4-b]pyridin-5-yl)benzamide;3-(2,2-difluoroethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propan-2-ylsulfamoylamino)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(pyrrolidin-1-ylsulfonylamino)benzamide;2,6-difluoro-N-(3-propan-2-yloxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propylsulfonylamino)benzamide;3-(dimethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2-fluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-5-(propylsulfonylamino)benzamide
SMILESCCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3[nH]nc(OC(C)C)c3c2)c1F.CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3[nH]nc(OC)c3c2)c1.CCS(=O)(=O)Nc1ccc(Cl)c(C(=O)Nc2cnc3[nH]ncc3c2)c1F.COc1n[nH]c2ncc(NC(=O)c3c(F)ccc(NS(=O)(=O)N(C)C)c3F)cc12.COc1n[nH]c2ncc(NC(=O)c3c(F)ccc(NS(=O)(=O)N4CCCC4)c3F)cc12.COc1n[nH]c2ncc(NC(=O)c3c(F)ccc(NS(=O)(=O)NC(C)C)c3F)cc12.COc1n[nH]c2ncc(NC(=O)c3c(F)ccc(NS(=O)(=O)NCC(F)F)c3F)cc12
InChIInChI=1S/C19H21F2N5O4S.C18H18F2N6O4S.C17H18F2N6O4S.C17H18FN5O4S.C16H14F4N6O4S.C16H16F2N6O4S.C15H13ClFN5O3S/c1-4-7-31(28,29)26-14-6-5-13(20)15(16(14)21)18(27)23-11-8-12-17(22-9-11)24-25-19(12)30-10(2)3;1-30-18-11-8-10(9-21-16(11)23-24-18)22-17(27)14-12(19)4-5-13(15(14)20)25-31(28,29)26-6-2-3-7-26;1-8(2)24-30(27,28)25-12-5-4-11(18)13(14(12)19)16(26)21-9-6-10-15(20-7-9)22-23-17(10)29-3;1-3-6-28(25,26)23-10-4-5-14(18)12(7-10)16(24)20-11-8-13-15(19-9-11)21-22-17(13)27-2;1-30-16-8-4-7(5-21-14(8)24-25-16)23-15(27)12-9(17)2-3-10(13(12)20)26-31(28,29)22-6-11(18)19;1-24(2)29(26,27)23-11-5-4-10(17)12(13(11)18)15(25)20-8-6-9-14(19-7-8)21-22-16(9)28-3;1-2-26(24,25)22-11-4-3-10(16)12(13(11)17)15(23)20-9-5-8-6-19-21-14(8)18-7-9/h5-6,8-10,26H,4,7H2,1-3H3,(H,23,27)(H,22,24,25);4-5,8-9,25H,2-3,6-7H2,1H3,(H,22,27)(H,21,23,24);4-8,24-25H,1-3H3,(H,21,26)(H,20,22,23);4-5,7-9,23H,3,6H2,1-2H3,(H,20,24)(H,19,21,22);2-5,11,22,26H,6H2,1H3,(H,23,27)(H,21,24,25);4-7,23H,1-3H3,(H,20,25)(H,19,21,22);3-7,22H,2H2,1H3,(H,20,23)(H,18,19,21)
InChIKeyMHOBRIZGUIVBCB-UHFFFAOYSA-N
MW3040.38 g/mol
LogP16.83
Rot. Bonds47

About 6-chloro-3-(ethylsulfonylamino)-2-fluoro-N-(1H-pyrazolo[3,4-b]pyridin-5-yl)benzamide;3-(2,2-difluoroethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propan-2-ylsulfamoylamino)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(pyrrolidin-1-ylsulfonylamino)benzamide;2,6-difluoro-N-(3-propan-2-yloxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propylsulfonylamino)benzamide;3-(dimethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2-fluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-5-(propylsulfonylamino)benzamide

6-chloro-3-(ethylsulfonylamino)-2-fluoro-N-(1H-pyrazolo[3,4-b]pyridin-5-yl)benzamide;3-(2,2-difluoroethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propan-2-ylsulfamoylamino)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(pyrrolidin-1-ylsulfonylamino)benzamide;2,6-difluoro-N-(3-propan-2-yloxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propylsulfonylamino)benzamide;3-(dimethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2-fluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-5-(propylsulfonylamino)benzamide (PubChem CID 159568841) has the molecular formula C118H118ClF14N39O27S7 and a molecular weight of 3040.38 g/mol. Its IUPAC name is 6-chloro-3-(ethylsulfonylamino)-2-fluoro-N-(1H-pyrazolo[3,4-b]pyridin-5-yl)benzamide;3-(2,2-difluoroethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propan-2-ylsulfamoylamino)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(pyrrolidin-1-ylsulfonylamino)benzamide;2,6-difluoro-N-(3-propan-2-yloxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propylsulfonylamino)benzamide;3-(dimethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2-fluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-5-(propylsulfonylamino)benzamide.

Molecular Properties

Compound Name6-chloro-3-(ethylsulfonylamino)-2-fluoro-N-(1H-pyrazolo[3,4-b]pyridin-5-yl)benzamide;3-(2,2-difluoroethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propan-2-ylsulfamoylamino)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(pyrrolidin-1-ylsulfonylamino)benzamide;2,6-difluoro-N-(3-propan-2-yloxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propylsulfonylamino)benzamide;3-(dimethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2-fluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-5-(propylsulfonylamino)benzamide
PubChem CID159568841
Molecular FormulaC118H118ClF14N39O27S7
Molecular Weight3040.38 g/mol
Exact Mass3037.66
IUPAC Name6-chloro-3-(ethylsulfonylamino)-2-fluoro-N-(1H-pyrazolo[3,4-b]pyridin-5-yl)benzamide;3-(2,2-difluoroethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propan-2-ylsulfamoylamino)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(pyrrolidin-1-ylsulfonylamino)benzamide;2,6-difluoro-N-(3-propan-2-yloxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propylsulfonylamino)benzamide;3-(dimethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2-fluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-5-(propylsulfonylamino)benzamide
SMILESCCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3[nH]nc(OC(C)C)c3c2)c1F.CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3[nH]nc(OC)c3c2)c1.CCS(=O)(=O)Nc1ccc(Cl)c(C(=O)Nc2cnc3[nH]ncc3c2)c1F.COc1n[nH]c2ncc(NC(=O)c3c(F)ccc(NS(=O)(=O)N(C)C)c3F)cc12.COc1n[nH]c2ncc(NC(=O)c3c(F)ccc(NS(=O)(=O)N4CCCC4)c3F)cc12.COc1n[nH]c2ncc(NC(=O)c3c(F)ccc(NS(=O)(=O)NC(C)C)c3F)cc12.COc1n[nH]c2ncc(NC(=O)c3c(F)ccc(NS(=O)(=O)NCC(F)F)c3F)cc12
InChIInChI=1S/C19H21F2N5O4S.C18H18F2N6O4S.C17H18F2N6O4S.C17H18FN5O4S.C16H14F4N6O4S.C16H16F2N6O4S.C15H13ClFN5O3S/c1-4-7-31(28,29)26-14-6-5-13(20)15(16(14)21)18(27)23-11-8-12-17(22-9-11)24-25-19(12)30-10(2)3;1-30-18-11-8-10(9-21-16(11)23-24-18)22-17(27)14-12(19)4-5-13(15(14)20)25-31(28,29)26-6-2-3-7-26;1-8(2)24-30(27,28)25-12-5-4-11(18)13(14(12)19)16(26)21-9-6-10-15(20-7-9)22-23-17(10)29-3;1-3-6-28(25,26)23-10-4-5-14(18)12(7-10)16(24)20-11-8-13-15(19-9-11)21-22-17(13)27-2;1-30-16-8-4-7(5-21-14(8)24-25-16)23-15(27)12-9(17)2-3-10(13(12)20)26-31(28,29)22-6-11(18)19;1-24(2)29(26,27)23-11-5-4-10(17)12(13(11)18)15(25)20-8-6-9-14(19-7-8)21-22-16(9)28-3;1-2-26(24,25)22-11-4-3-10(16)12(13(11)17)15(23)20-9-5-8-6-19-21-14(8)18-7-9/h5-6,8-10,26H,4,7H2,1-3H3,(H,23,27)(H,22,24,25);4-5,8-9,25H,2-3,6-7H2,1H3,(H,22,27)(H,21,23,24);4-8,24-25H,1-3H3,(H,21,26)(H,20,22,23);4-5,7-9,23H,3,6H2,1-2H3,(H,20,24)(H,19,21,22);2-5,11,22,26H,6H2,1H3,(H,23,27)(H,21,24,25);4-7,23H,1-3H3,(H,20,25)(H,19,21,22);3-7,22H,2H2,1H3,(H,20,23)(H,18,19,21)
InChIKeyMHOBRIZGUIVBCB-UHFFFAOYSA-N
XLogP16.83
TPSA903.80 Ų
H-Bond Donors23
H-Bond Acceptors41
Rotatable Bonds47
Heavy Atoms206
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003040.38
LogP ≤ 516.83
H-Bond Donors ≤ 523
H-Bond Acceptors ≤ 1041

Analyze 6-chloro-3-(ethylsulfonylamino)-2-fluoro-N-(1H-pyrazolo[3,4-b]pyridin-5-yl)benzamide;3-(2,2-difluoroethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propan-2-ylsulfamoylamino)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(pyrrolidin-1-ylsulfonylamino)benzamide;2,6-difluoro-N-(3-propan-2-yloxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propylsulfonylamino)benzamide;3-(dimethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2-fluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-5-(propylsulfonylamino)benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-(ethylsulfonylamino)-2-fluoro-N-(1H-pyrazolo[3,4-b]pyridin-5-yl)benzamide;3-(2,2-difluoroethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propan-2-ylsulfamoylamino)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(pyrrolidin-1-ylsulfonylamino)benzamide;2,6-difluoro-N-(3-propan-2-yloxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propylsulfonylamino)benzamide;3-(dimethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2-fluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-5-(propylsulfonylamino)benzamide?
The IUPAC name of 6-chloro-3-(ethylsulfonylamino)-2-fluoro-N-(1H-pyrazolo[3,4-b]pyridin-5-yl)benzamide;3-(2,2-difluoroethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propan-2-ylsulfamoylamino)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(pyrrolidin-1-ylsulfonylamino)benzamide;2,6-difluoro-N-(3-propan-2-yloxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propylsulfonylamino)benzamide;3-(dimethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2-fluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-5-(propylsulfonylamino)benzamide (CID 159568841) is 6-chloro-3-(ethylsulfonylamino)-2-fluoro-N-(1H-pyrazolo[3,4-b]pyridin-5-yl)benzamide;3-(2,2-difluoroethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propan-2-ylsulfamoylamino)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(pyrrolidin-1-ylsulfonylamino)benzamide;2,6-difluoro-N-(3-propan-2-yloxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propylsulfonylamino)benzamide;3-(dimethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2-fluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-5-(propylsulfonylamino)benzamide.
What is the SMILES notation for 6-chloro-3-(ethylsulfonylamino)-2-fluoro-N-(1H-pyrazolo[3,4-b]pyridin-5-yl)benzamide;3-(2,2-difluoroethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propan-2-ylsulfamoylamino)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(pyrrolidin-1-ylsulfonylamino)benzamide;2,6-difluoro-N-(3-propan-2-yloxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propylsulfonylamino)benzamide;3-(dimethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2-fluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-5-(propylsulfonylamino)benzamide?
The canonical SMILES for 6-chloro-3-(ethylsulfonylamino)-2-fluoro-N-(1H-pyrazolo[3,4-b]pyridin-5-yl)benzamide;3-(2,2-difluoroethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propan-2-ylsulfamoylamino)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(pyrrolidin-1-ylsulfonylamino)benzamide;2,6-difluoro-N-(3-propan-2-yloxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propylsulfonylamino)benzamide;3-(dimethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2-fluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-5-(propylsulfonylamino)benzamide is CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3[nH]nc(OC(C)C)c3c2)c1F.CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3[nH]nc(OC)c3c2)c1.CCS(=O)(=O)Nc1ccc(Cl)c(C(=O)Nc2cnc3[nH]ncc3c2)c1F.COc1n[nH]c2ncc(NC(=O)c3c(F)ccc(NS(=O)(=O)N(C)C)c3F)cc12.COc1n[nH]c2ncc(NC(=O)c3c(F)ccc(NS(=O)(=O)N4CCCC4)c3F)cc12.COc1n[nH]c2ncc(NC(=O)c3c(F)ccc(NS(=O)(=O)NC(C)C)c3F)cc12.COc1n[nH]c2ncc(NC(=O)c3c(F)ccc(NS(=O)(=O)NCC(F)F)c3F)cc12.
What is the InChIKey of 6-chloro-3-(ethylsulfonylamino)-2-fluoro-N-(1H-pyrazolo[3,4-b]pyridin-5-yl)benzamide;3-(2,2-difluoroethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propan-2-ylsulfamoylamino)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(pyrrolidin-1-ylsulfonylamino)benzamide;2,6-difluoro-N-(3-propan-2-yloxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propylsulfonylamino)benzamide;3-(dimethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2-fluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-5-(propylsulfonylamino)benzamide?
The InChIKey is MHOBRIZGUIVBCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21F2N5O4S.C18H18F2N6O4S.C17H18F2N6O4S.C17H18FN5O4S.C16H14F4N6O4S.C16H16F2N6O4S.C15H13ClFN5O3S/c1-4-7-31(28,29)26-14-6-5-13(20)15(16(14)21)18(27)23-11-8-12-17(22-9-11)24-25-19(12)30-10(2)3;1-30-18-11-8-10(9-21-16(11)23-24-18)22-17(27)14-12(19)4-5-13(15(14)20)25-31(28,29)26-6-2-3-7-26;1-8(2)24-30(27,28)25-12-5-4-11(18)13(14(12)19)16(26)21-9-6-10-15(20-7-9)22-23-17(10)29-3;1-3-6-28(25,26)23-10-4-5-14(18)12(7-10)16(24)20-11-8-13-15(19-9-11)21-22-17(13)27-2;1-30-16-8-4-7(5-21-14(8)24-25-16)23-15(27)12-9(17)2-3-10(13(12)20)26-31(28,29)22-6-11(18)19;1-24(2)29(26,27)23-11-5-4-10(17)12(13(11)18)15(25)20-8-6-9-14(19-7-8)21-22-16(9)28-3;1-2-26(24,25)22-11-4-3-10(16)12(13(11)17)15(23)20-9-5-8-6-19-21-14(8)18-7-9/h5-6,8-10,26H,4,7H2,1-3H3,(H,23,27)(H,22,24,25);4-5,8-9,25H,2-3,6-7H2,1H3,(H,22,27)(H,21,23,24);4-8,24-25H,1-3H3,(H,21,26)(H,20,22,23);4-5,7-9,23H,3,6H2,1-2H3,(H,20,24)(H,19,21,22);2-5,11,22,26H,6H2,1H3,(H,23,27)(H,21,24,25);4-7,23H,1-3H3,(H,20,25)(H,19,21,22);3-7,22H,2H2,1H3,(H,20,23)(H,18,19,21).
What are the key properties of 6-chloro-3-(ethylsulfonylamino)-2-fluoro-N-(1H-pyrazolo[3,4-b]pyridin-5-yl)benzamide;3-(2,2-difluoroethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propan-2-ylsulfamoylamino)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(pyrrolidin-1-ylsulfonylamino)benzamide;2,6-difluoro-N-(3-propan-2-yloxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propylsulfonylamino)benzamide;3-(dimethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2-fluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-5-(propylsulfonylamino)benzamide?
6-chloro-3-(ethylsulfonylamino)-2-fluoro-N-(1H-pyrazolo[3,4-b]pyridin-5-yl)benzamide;3-(2,2-difluoroethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propan-2-ylsulfamoylamino)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(pyrrolidin-1-ylsulfonylamino)benzamide;2,6-difluoro-N-(3-propan-2-yloxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propylsulfonylamino)benzamide;3-(dimethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2-fluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-5-(propylsulfonylamino)benzamide has a molecular weight of 3040.38 g/mol, XLogP of 16.83, 47 rotatable bonds, 23 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-(ethylsulfonylamino)-2-fluoro-N-(1H-pyrazolo[3,4-b]pyridin-5-yl)benzamide;3-(2,2-difluoroethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propan-2-ylsulfamoylamino)benzamide;2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(pyrrolidin-1-ylsulfonylamino)benzamide;2,6-difluoro-N-(3-propan-2-yloxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-3-(propylsulfonylamino)benzamide;3-(dimethylsulfamoylamino)-2,6-difluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)benzamide;2-fluoro-N-(3-methoxy-1H-pyrazolo[5,4-b]pyridin-5-yl)-5-(propylsulfonylamino)benzamide is sourced from PubChem (CID 159568841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).