About 5-chloro-7-[(1S)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-7-[(1R)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-7-[1-(4-methylphenyl)-3-methylsulfanylpropyl]pyrazolo[3,4-b]pyridine;3-[4-(5-chloro-4-methylimidazol-1-yl)-3-methoxyphenyl]-5-(1,1-difluoroethyl)-7-[1-(3,5-difluoro-4-methylphenyl)propyl]pyrazolo[3,4-b]pyridine;7-[1-(3,5-difluoro-4-methylphenyl)propyl]-5-(4-fluorophenyl)-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine
5-chloro-7-[(1S)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-7-[(1R)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-7-[1-(4-methylphenyl)-3-methylsulfanylpropyl]pyrazolo[3,4-b]pyridine;3-[4-(5-chloro-4-methylimidazol-1-yl)-3-methoxyphenyl]-5-(1,1-difluoroethyl)-7-[1-(3,5-difluoro-4-methylphenyl)propyl]pyrazolo[3,4-b]pyridine;7-[1-(3,5-difluoro-4-methylphenyl)propyl]-5-(4-fluorophenyl)-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine (PubChem CID 159876189) has the molecular formula C142H126Cl4F11N25O5S
and a molecular weight of 2645.60 g/mol. Its IUPAC name is 5-chloro-7-[(1S)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-7-[(1R)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-7-[1-(4-methylphenyl)-3-methylsulfanylpropyl]pyrazolo[3,4-b]pyridine;3-[4-(5-chloro-4-methylimidazol-1-yl)-3-methoxyphenyl]-5-(1,1-difluoroethyl)-7-[1-(3,5-difluoro-4-methylphenyl)propyl]pyrazolo[3,4-b]pyridine;7-[1-(3,5-difluoro-4-methylphenyl)propyl]-5-(4-fluorophenyl)-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine.
Frequently Asked Questions
What is the IUPAC name of 5-chloro-7-[(1S)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-7-[(1R)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-7-[1-(4-methylphenyl)-3-methylsulfanylpropyl]pyrazolo[3,4-b]pyridine;3-[4-(5-chloro-4-methylimidazol-1-yl)-3-methoxyphenyl]-5-(1,1-difluoroethyl)-7-[1-(3,5-difluoro-4-methylphenyl)propyl]pyrazolo[3,4-b]pyridine;7-[1-(3,5-difluoro-4-methylphenyl)propyl]-5-(4-fluorophenyl)-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine?
The IUPAC name of 5-chloro-7-[(1S)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-7-[(1R)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-7-[1-(4-methylphenyl)-3-methylsulfanylpropyl]pyrazolo[3,4-b]pyridine;3-[4-(5-chloro-4-methylimidazol-1-yl)-3-methoxyphenyl]-5-(1,1-difluoroethyl)-7-[1-(3,5-difluoro-4-methylphenyl)propyl]pyrazolo[3,4-b]pyridine;7-[1-(3,5-difluoro-4-methylphenyl)propyl]-5-(4-fluorophenyl)-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine (CID 159876189) is 5-chloro-7-[(1S)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-7-[(1R)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-7-[1-(4-methylphenyl)-3-methylsulfanylpropyl]pyrazolo[3,4-b]pyridine;3-[4-(5-chloro-4-methylimidazol-1-yl)-3-methoxyphenyl]-5-(1,1-difluoroethyl)-7-[1-(3,5-difluoro-4-methylphenyl)propyl]pyrazolo[3,4-b]pyridine;7-[1-(3,5-difluoro-4-methylphenyl)propyl]-5-(4-fluorophenyl)-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine.
What is the SMILES notation for 5-chloro-7-[(1S)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-7-[(1R)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-7-[1-(4-methylphenyl)-3-methylsulfanylpropyl]pyrazolo[3,4-b]pyridine;3-[4-(5-chloro-4-methylimidazol-1-yl)-3-methoxyphenyl]-5-(1,1-difluoroethyl)-7-[1-(3,5-difluoro-4-methylphenyl)propyl]pyrazolo[3,4-b]pyridine;7-[1-(3,5-difluoro-4-methylphenyl)propyl]-5-(4-fluorophenyl)-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine?
The canonical SMILES for 5-chloro-7-[(1S)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-7-[(1R)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-7-[1-(4-methylphenyl)-3-methylsulfanylpropyl]pyrazolo[3,4-b]pyridine;3-[4-(5-chloro-4-methylimidazol-1-yl)-3-methoxyphenyl]-5-(1,1-difluoroethyl)-7-[1-(3,5-difluoro-4-methylphenyl)propyl]pyrazolo[3,4-b]pyridine;7-[1-(3,5-difluoro-4-methylphenyl)propyl]-5-(4-fluorophenyl)-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine is CCC(c1cc(F)c(C)c(F)c1)n1cc(-c2ccc(F)cc2)cc2c(-c3ccc(-n4cnc(C)c4)c(OC)c3)nnc1-2.CCC(c1cc(F)c(C)c(F)c1)n1cc(C(C)(F)F)cc2c(-c3ccc(-n4cnc(C)c4Cl)c(OC)c3)nnc1-2.COc1cc(-c2nnc3n(C(CCSC)c4ccc(C)cc4)cc(Cl)cc2-3)ccc1-n1cnc(C)c1.COc1cc(-c2nnc3n([C@@H](C)c4cc(F)c(C)c(F)c4)cc(Cl)cc2-3)ccc1-n1cnc(C)c1.COc1cc(-c2nnc3n([C@H](C)c4cc(F)c(C)c(F)c4)cc(Cl)cc2-3)ccc1-n1cnc(C)c1.
What is the InChIKey of 5-chloro-7-[(1S)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-7-[(1R)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-7-[1-(4-methylphenyl)-3-methylsulfanylpropyl]pyrazolo[3,4-b]pyridine;3-[4-(5-chloro-4-methylimidazol-1-yl)-3-methoxyphenyl]-5-(1,1-difluoroethyl)-7-[1-(3,5-difluoro-4-methylphenyl)propyl]pyrazolo[3,4-b]pyridine;7-[1-(3,5-difluoro-4-methylphenyl)propyl]-5-(4-fluorophenyl)-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine?
The InChIKey is NSXYKBRFMBBUHZ-JGBMOPGWSA-N. The full InChI is InChI=1S/C33H28F3N5O.C29H26ClF4N5O.C28H28ClN5OS.2C26H22ClF2N5O/c1-5-29(23-13-27(35)20(3)28(36)14-23)41-17-24(21-6-9-25(34)10-7-21)12-26-32(38-39-33(26)41)22-8-11-30(31(15-22)42-4)40-16-19(2)37-18-40;1-6-23(18-9-21(31)15(2)22(32)10-18)38-13-19(29(4,33)34)12-20-26(36-37-28(20)38)17-7-8-24(25(11-17)40-5)39-14-35-16(3)27(39)30;1-18-5-7-20(8-6-18)24(11-12-36-4)34-16-22(29)14-23-27(31-32-28(23)34)21-9-10-25(26(13-21)35-3)33-15-19(2)30-17-33;2*1-14-11-33(13-30-14)23-6-5-17(9-24(23)35-4)25-20-10-19(27)12-34(26(20)32-31-25)16(3)18-7-21(28)15(2)22(29)8-18/h6-18,29H,5H2,1-4H3;7-14,23H,6H2,1-5H3;5-10,13-17,24H,11-12H2,1-4H3;2*5-13,16H,1-4H3/t;;;2*16-/m...10/s1.
What are the key properties of 5-chloro-7-[(1S)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-7-[(1R)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-7-[1-(4-methylphenyl)-3-methylsulfanylpropyl]pyrazolo[3,4-b]pyridine;3-[4-(5-chloro-4-methylimidazol-1-yl)-3-methoxyphenyl]-5-(1,1-difluoroethyl)-7-[1-(3,5-difluoro-4-methylphenyl)propyl]pyrazolo[3,4-b]pyridine;7-[1-(3,5-difluoro-4-methylphenyl)propyl]-5-(4-fluorophenyl)-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine?
5-chloro-7-[(1S)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-7-[(1R)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-7-[1-(4-methylphenyl)-3-methylsulfanylpropyl]pyrazolo[3,4-b]pyridine;3-[4-(5-chloro-4-methylimidazol-1-yl)-3-methoxyphenyl]-5-(1,1-difluoroethyl)-7-[1-(3,5-difluoro-4-methylphenyl)propyl]pyrazolo[3,4-b]pyridine;7-[1-(3,5-difluoro-4-methylphenyl)propyl]-5-(4-fluorophenyl)-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine has a molecular weight of 2645.60 g/mol, XLogP of 35.51, 32 rotatable bonds, 0 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-7-[(1S)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-7-[(1R)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-7-[1-(4-methylphenyl)-3-methylsulfanylpropyl]pyrazolo[3,4-b]pyridine;3-[4-(5-chloro-4-methylimidazol-1-yl)-3-methoxyphenyl]-5-(1,1-difluoroethyl)-7-[1-(3,5-difluoro-4-methylphenyl)propyl]pyrazolo[3,4-b]pyridine;7-[1-(3,5-difluoro-4-methylphenyl)propyl]-5-(4-fluorophenyl)-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine is sourced from PubChem (CID 159876189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).