3-(2-chloro-3-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(3-chlorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2,4-difluorophenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;3-(2-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-[3-[4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-yl]-2-pyridinyl]morpholine;4-(5-methylthiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine

C175H129Cl5F7N33O5S10 — CID 158661799

IUPAC3-(2-chloro-3-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(3-chlorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2,4-difluorophenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;3-(2-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-[3-[4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-yl]-2-pyridinyl]morpholine;4-(5-methylthiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine
SMILESCOc1cc(Cl)ccc1-c1[nH]nc2nccc(-c3ccc(C)s3)c12.COc1ccc(-c2[nH]nc3nccc(-c4ccc(C)s4)c23)cc1.COc1ccccc1-c1[nH]nc2nccc(-c3ccc(Cl)s3)c12.COc1ncccc1-c1[nH]nc2nccc(-c3ccc(C)s3)c12.Cc1ccc(-c2ccnc3n[nH]c(-c4cccc(Cl)c4)c23)s1.Cc1ccc(-c2ccnc3n[nH]c(-c4cccc(F)c4Cl)c23)s1.Cc1ccc(-c2ccnc3n[nH]c(-c4ccccc4C(F)(F)F)c23)s1.Cc1ccc(-c2ccnc3n[nH]c(-c4ccccc4F)c23)s1.Cc1ccc(-c2ccnc3n[nH]c(-c4cccnc4N4CCOCC4)c23)s1.Fc1ccc(-c2[nH]nc3nccc(-c4ccc(Cl)s4)c23)c(F)c1
InChIInChI=1S/C20H19N5OS.C18H14ClN3OS.C18H12F3N3S.C18H15N3OS.C17H11ClFN3S.C17H12ClN3OS.C17H12ClN3S.C17H12FN3S.C17H14N4OS.C16H8ClF2N3S/c1-13-4-5-16(27-13)14-6-8-21-19-17(14)18(23-24-19)15-3-2-7-22-20(15)25-9-11-26-12-10-25;1-10-3-6-15(24-10)13-7-8-20-18-16(13)17(21-22-18)12-5-4-11(19)9-14(12)23-2;1-10-6-7-14(25-10)12-8-9-22-17-15(12)16(23-24-17)11-4-2-3-5-13(11)18(19,20)21;1-11-3-8-15(23-11)14-9-10-19-18-16(14)17(20-21-18)12-4-6-13(22-2)7-5-12;1-9-5-6-13(23-9)10-7-8-20-17-14(10)16(21-22-17)11-3-2-4-12(19)15(11)18;1-22-12-5-3-2-4-10(12)16-15-11(13-6-7-14(18)23-13)8-9-19-17(15)21-20-16;1-10-5-6-14(22-10)13-7-8-19-17-15(13)16(20-21-17)11-3-2-4-12(18)9-11;1-10-6-7-14(22-10)12-8-9-19-17-15(12)16(20-21-17)11-4-2-3-5-13(11)18;1-10-5-6-13(23-10)11-7-9-18-16-14(11)15(20-21-16)12-4-3-8-19-17(12)22-2;17-13-4-3-12(23-13)10-5-6-20-16-14(10)15(21-22-16)9-2-1-8(18)7-11(9)19/h2-8H,9-12H2,1H3,(H,21,23,24);3-9H,1-2H3,(H,20,21,22);2-9H,1H3,(H,22,23,24);3-10H,1-2H3,(H,19,20,21);2-8H,1H3,(H,20,21,22);2-9H,1H3,(H,19,20,21);2*2-9H,1H3,(H,19,20,21);3-9H,1-2H3,(H,18,20,21);1-7H,(H,20,21,22)
InChIKeyICVQYXJREITMAF-UHFFFAOYSA-N
MW3405.10 g/mol
LogP49.50
Rot. Bonds25

About 3-(2-chloro-3-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(3-chlorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2,4-difluorophenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;3-(2-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-[3-[4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-yl]-2-pyridinyl]morpholine;4-(5-methylthiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine

3-(2-chloro-3-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(3-chlorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2,4-difluorophenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;3-(2-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-[3-[4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-yl]-2-pyridinyl]morpholine;4-(5-methylthiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine (PubChem CID 158661799) has the molecular formula C175H129Cl5F7N33O5S10 and a molecular weight of 3405.10 g/mol. Its IUPAC name is 3-(2-chloro-3-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(3-chlorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2,4-difluorophenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;3-(2-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-[3-[4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-yl]-2-pyridinyl]morpholine;4-(5-methylthiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine.

Molecular Properties

Compound Name3-(2-chloro-3-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(3-chlorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2,4-difluorophenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;3-(2-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-[3-[4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-yl]-2-pyridinyl]morpholine;4-(5-methylthiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine
PubChem CID158661799
Molecular FormulaC175H129Cl5F7N33O5S10
Molecular Weight3405.10 g/mol
Exact Mass3399.64
IUPAC Name3-(2-chloro-3-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(3-chlorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2,4-difluorophenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;3-(2-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-[3-[4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-yl]-2-pyridinyl]morpholine;4-(5-methylthiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine
SMILESCOc1cc(Cl)ccc1-c1[nH]nc2nccc(-c3ccc(C)s3)c12.COc1ccc(-c2[nH]nc3nccc(-c4ccc(C)s4)c23)cc1.COc1ccccc1-c1[nH]nc2nccc(-c3ccc(Cl)s3)c12.COc1ncccc1-c1[nH]nc2nccc(-c3ccc(C)s3)c12.Cc1ccc(-c2ccnc3n[nH]c(-c4cccc(Cl)c4)c23)s1.Cc1ccc(-c2ccnc3n[nH]c(-c4cccc(F)c4Cl)c23)s1.Cc1ccc(-c2ccnc3n[nH]c(-c4ccccc4C(F)(F)F)c23)s1.Cc1ccc(-c2ccnc3n[nH]c(-c4ccccc4F)c23)s1.Cc1ccc(-c2ccnc3n[nH]c(-c4cccnc4N4CCOCC4)c23)s1.Fc1ccc(-c2[nH]nc3nccc(-c4ccc(Cl)s4)c23)c(F)c1
InChIInChI=1S/C20H19N5OS.C18H14ClN3OS.C18H12F3N3S.C18H15N3OS.C17H11ClFN3S.C17H12ClN3OS.C17H12ClN3S.C17H12FN3S.C17H14N4OS.C16H8ClF2N3S/c1-13-4-5-16(27-13)14-6-8-21-19-17(14)18(23-24-19)15-3-2-7-22-20(15)25-9-11-26-12-10-25;1-10-3-6-15(24-10)13-7-8-20-18-16(13)17(21-22-18)12-5-4-11(19)9-14(12)23-2;1-10-6-7-14(25-10)12-8-9-22-17-15(12)16(23-24-17)11-4-2-3-5-13(11)18(19,20)21;1-11-3-8-15(23-11)14-9-10-19-18-16(14)17(20-21-18)12-4-6-13(22-2)7-5-12;1-9-5-6-13(23-9)10-7-8-20-17-14(10)16(21-22-17)11-3-2-4-12(19)15(11)18;1-22-12-5-3-2-4-10(12)16-15-11(13-6-7-14(18)23-13)8-9-19-17(15)21-20-16;1-10-5-6-14(22-10)13-7-8-19-17-15(13)16(20-21-17)11-3-2-4-12(18)9-11;1-10-6-7-14(22-10)12-8-9-19-17-15(12)16(20-21-17)11-4-2-3-5-13(11)18;1-10-5-6-13(23-10)11-7-9-18-16-14(11)15(20-21-16)12-4-3-8-19-17(12)22-2;17-13-4-3-12(23-13)10-5-6-20-16-14(10)15(21-22-16)9-2-1-8(18)7-11(9)19/h2-8H,9-12H2,1H3,(H,21,23,24);3-9H,1-2H3,(H,20,21,22);2-9H,1H3,(H,22,23,24);3-10H,1-2H3,(H,19,20,21);2-8H,1H3,(H,20,21,22);2-9H,1H3,(H,19,20,21);2*2-9H,1H3,(H,19,20,21);3-9H,1-2H3,(H,18,20,21);1-7H,(H,20,21,22)
InChIKeyICVQYXJREITMAF-UHFFFAOYSA-N
XLogP49.50
TPSA490.87 Ų
H-Bond Donors10
H-Bond Acceptors38
Rotatable Bonds25
Heavy Atoms235
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003405.10
LogP ≤ 549.50
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1038

Analyze 3-(2-chloro-3-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(3-chlorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2,4-difluorophenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;3-(2-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-[3-[4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-yl]-2-pyridinyl]morpholine;4-(5-methylthiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-(2-chloro-3-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(3-chlorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2,4-difluorophenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;3-(2-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-[3-[4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-yl]-2-pyridinyl]morpholine;4-(5-methylthiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine?
The IUPAC name of 3-(2-chloro-3-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(3-chlorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2,4-difluorophenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;3-(2-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-[3-[4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-yl]-2-pyridinyl]morpholine;4-(5-methylthiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine (CID 158661799) is 3-(2-chloro-3-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(3-chlorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2,4-difluorophenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;3-(2-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-[3-[4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-yl]-2-pyridinyl]morpholine;4-(5-methylthiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine.
What is the SMILES notation for 3-(2-chloro-3-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(3-chlorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2,4-difluorophenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;3-(2-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-[3-[4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-yl]-2-pyridinyl]morpholine;4-(5-methylthiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine?
The canonical SMILES for 3-(2-chloro-3-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(3-chlorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2,4-difluorophenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;3-(2-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-[3-[4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-yl]-2-pyridinyl]morpholine;4-(5-methylthiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine is COc1cc(Cl)ccc1-c1[nH]nc2nccc(-c3ccc(C)s3)c12.COc1ccc(-c2[nH]nc3nccc(-c4ccc(C)s4)c23)cc1.COc1ccccc1-c1[nH]nc2nccc(-c3ccc(Cl)s3)c12.COc1ncccc1-c1[nH]nc2nccc(-c3ccc(C)s3)c12.Cc1ccc(-c2ccnc3n[nH]c(-c4cccc(Cl)c4)c23)s1.Cc1ccc(-c2ccnc3n[nH]c(-c4cccc(F)c4Cl)c23)s1.Cc1ccc(-c2ccnc3n[nH]c(-c4ccccc4C(F)(F)F)c23)s1.Cc1ccc(-c2ccnc3n[nH]c(-c4ccccc4F)c23)s1.Cc1ccc(-c2ccnc3n[nH]c(-c4cccnc4N4CCOCC4)c23)s1.Fc1ccc(-c2[nH]nc3nccc(-c4ccc(Cl)s4)c23)c(F)c1.
What is the InChIKey of 3-(2-chloro-3-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(3-chlorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2,4-difluorophenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;3-(2-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-[3-[4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-yl]-2-pyridinyl]morpholine;4-(5-methylthiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine?
The InChIKey is ICVQYXJREITMAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5OS.C18H14ClN3OS.C18H12F3N3S.C18H15N3OS.C17H11ClFN3S.C17H12ClN3OS.C17H12ClN3S.C17H12FN3S.C17H14N4OS.C16H8ClF2N3S/c1-13-4-5-16(27-13)14-6-8-21-19-17(14)18(23-24-19)15-3-2-7-22-20(15)25-9-11-26-12-10-25;1-10-3-6-15(24-10)13-7-8-20-18-16(13)17(21-22-18)12-5-4-11(19)9-14(12)23-2;1-10-6-7-14(25-10)12-8-9-22-17-15(12)16(23-24-17)11-4-2-3-5-13(11)18(19,20)21;1-11-3-8-15(23-11)14-9-10-19-18-16(14)17(20-21-18)12-4-6-13(22-2)7-5-12;1-9-5-6-13(23-9)10-7-8-20-17-14(10)16(21-22-17)11-3-2-4-12(19)15(11)18;1-22-12-5-3-2-4-10(12)16-15-11(13-6-7-14(18)23-13)8-9-19-17(15)21-20-16;1-10-5-6-14(22-10)13-7-8-19-17-15(13)16(20-21-17)11-3-2-4-12(18)9-11;1-10-6-7-14(22-10)12-8-9-19-17-15(12)16(20-21-17)11-4-2-3-5-13(11)18;1-10-5-6-13(23-10)11-7-9-18-16-14(11)15(20-21-16)12-4-3-8-19-17(12)22-2;17-13-4-3-12(23-13)10-5-6-20-16-14(10)15(21-22-16)9-2-1-8(18)7-11(9)19/h2-8H,9-12H2,1H3,(H,21,23,24);3-9H,1-2H3,(H,20,21,22);2-9H,1H3,(H,22,23,24);3-10H,1-2H3,(H,19,20,21);2-8H,1H3,(H,20,21,22);2-9H,1H3,(H,19,20,21);2*2-9H,1H3,(H,19,20,21);3-9H,1-2H3,(H,18,20,21);1-7H,(H,20,21,22).
What are the key properties of 3-(2-chloro-3-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(3-chlorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2,4-difluorophenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;3-(2-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-[3-[4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-yl]-2-pyridinyl]morpholine;4-(5-methylthiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine?
3-(2-chloro-3-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(3-chlorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2,4-difluorophenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;3-(2-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-[3-[4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-yl]-2-pyridinyl]morpholine;4-(5-methylthiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine has a molecular weight of 3405.10 g/mol, XLogP of 49.50, 25 rotatable bonds, 10 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-chloro-3-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(3-chlorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2,4-difluorophenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;3-(2-fluorophenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-methoxyphenyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-[3-[4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-yl]-2-pyridinyl]morpholine;4-(5-methylthiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine is sourced from PubChem (CID 158661799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).