6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;5-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-7-(4-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-6-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-3-methylimidazo[4,5-b]pyridin-5-one

C187H148ClF12N29O25 — CID 159906320

IUPAC6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;5-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-7-(4-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-6-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-3-methylimidazo[4,5-b]pyridin-5-one
SMILESCOc1cc2c(Oc3ccc(CC(=O)c4cc5cnn(C)c5n(-c5ccc(F)cc5)c4=O)cc3F)ccnc2cc1OCCCN1CCOCC1.COc1cc2c(Oc3ccc(CC(=O)c4cc5ncn(C)c5n(-c5ccc(F)cc5)c4=O)cc3F)ccnc2cc1OCCCN1CCOCC1.COc1ccc2c(Oc3ccc(CC(=O)c4cc5ncn(C)c5n(-c5ccc(F)cc5)c4=O)cc3F)ccnc2c1.Cn1cnc2cc(C(=O)Cc3ccc(Oc4ccnc(N)c4)c(F)c3)c(=O)n(-c3ccc(F)cc3)c21.Cn1cnc2cc(C(=O)Cc3ccc(Oc4ccnc(N)c4Cl)c(F)c3)c(=O)n(-c3ccc(F)cc3)c21.Cn1cnc2cc(C(=O)Cc3ccc(Oc4ccnc5[nH]ccc45)c(F)c3)c(=O)n(-c3ccc(F)cc3)c21
InChIInChI=1S/2C38H35F2N5O6.C31H22F2N4O4.C28H19F2N5O3.C26H18ClF2N5O3.C26H19F2N5O3/c1-43-37-25(23-42-43)20-29(38(47)45(37)27-7-5-26(39)6-8-27)32(46)19-24-4-9-34(30(40)18-24)51-33-10-11-41-31-22-36(35(48-2)21-28(31)33)50-15-3-12-44-13-16-49-17-14-44;1-43-23-42-31-20-28(38(47)45(37(31)43)26-7-5-25(39)6-8-26)32(46)19-24-4-9-34(29(40)18-24)51-33-10-11-41-30-22-36(35(48-2)21-27(30)33)50-15-3-12-44-13-16-49-17-14-44;1-36-17-35-26-16-23(31(39)37(30(26)36)20-6-4-19(32)5-7-20)27(38)14-18-3-10-29(24(33)13-18)41-28-11-12-34-25-15-21(40-2)8-9-22(25)28;1-34-15-33-22-14-20(28(37)35(27(22)34)18-5-3-17(29)4-6-18)23(36)13-16-2-7-25(21(30)12-16)38-24-9-11-32-26-19(24)8-10-31-26;1-33-13-32-19-12-17(26(36)34(25(19)33)16-5-3-15(28)4-6-16)20(35)11-14-2-7-21(18(29)10-14)37-22-8-9-31-24(30)23(22)27;1-32-14-31-21-13-19(26(35)33(25(21)32)17-5-3-16(27)4-6-17)22(34)11-15-2-7-23(20(28)10-15)36-18-8-9-30-24(29)12-18/h2*4-11,18,20-23H,3,12-17,19H2,1-2H3;3-13,15-17H,14H2,1-2H3;2-12,14-15H,13H2,1H3,(H,31,32);2-10,12-13H,11H2,1H3,(H2,30,31);2-10,12-14H,11H2,1H3,(H2,29,30)
InChIKeyNWPSBBQKGOQEEW-UHFFFAOYSA-N
MW3464.85 g/mol
LogP31.68
Rot. Bonds49

About 6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;5-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-7-(4-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-6-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-3-methylimidazo[4,5-b]pyridin-5-one

6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;5-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-7-(4-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-6-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-3-methylimidazo[4,5-b]pyridin-5-one (PubChem CID 159906320) has the molecular formula C187H148ClF12N29O25 and a molecular weight of 3464.85 g/mol. Its IUPAC name is 6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;5-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-7-(4-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-6-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-3-methylimidazo[4,5-b]pyridin-5-one.

Molecular Properties

Compound Name6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;5-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-7-(4-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-6-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-3-methylimidazo[4,5-b]pyridin-5-one
PubChem CID159906320
Molecular FormulaC187H148ClF12N29O25
Molecular Weight3464.85 g/mol
Exact Mass3462.07
IUPAC Name6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;5-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-7-(4-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-6-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-3-methylimidazo[4,5-b]pyridin-5-one
SMILESCOc1cc2c(Oc3ccc(CC(=O)c4cc5cnn(C)c5n(-c5ccc(F)cc5)c4=O)cc3F)ccnc2cc1OCCCN1CCOCC1.COc1cc2c(Oc3ccc(CC(=O)c4cc5ncn(C)c5n(-c5ccc(F)cc5)c4=O)cc3F)ccnc2cc1OCCCN1CCOCC1.COc1ccc2c(Oc3ccc(CC(=O)c4cc5ncn(C)c5n(-c5ccc(F)cc5)c4=O)cc3F)ccnc2c1.Cn1cnc2cc(C(=O)Cc3ccc(Oc4ccnc(N)c4)c(F)c3)c(=O)n(-c3ccc(F)cc3)c21.Cn1cnc2cc(C(=O)Cc3ccc(Oc4ccnc(N)c4Cl)c(F)c3)c(=O)n(-c3ccc(F)cc3)c21.Cn1cnc2cc(C(=O)Cc3ccc(Oc4ccnc5[nH]ccc45)c(F)c3)c(=O)n(-c3ccc(F)cc3)c21
InChIInChI=1S/2C38H35F2N5O6.C31H22F2N4O4.C28H19F2N5O3.C26H18ClF2N5O3.C26H19F2N5O3/c1-43-37-25(23-42-43)20-29(38(47)45(37)27-7-5-26(39)6-8-27)32(46)19-24-4-9-34(30(40)18-24)51-33-10-11-41-31-22-36(35(48-2)21-28(31)33)50-15-3-12-44-13-16-49-17-14-44;1-43-23-42-31-20-28(38(47)45(37(31)43)26-7-5-25(39)6-8-26)32(46)19-24-4-9-34(29(40)18-24)51-33-10-11-41-30-22-36(35(48-2)21-27(30)33)50-15-3-12-44-13-16-49-17-14-44;1-36-17-35-26-16-23(31(39)37(30(26)36)20-6-4-19(32)5-7-20)27(38)14-18-3-10-29(24(33)13-18)41-28-11-12-34-25-15-21(40-2)8-9-22(25)28;1-34-15-33-22-14-20(28(37)35(27(22)34)18-5-3-17(29)4-6-18)23(36)13-16-2-7-25(21(30)12-16)38-24-9-11-32-26-19(24)8-10-31-26;1-33-13-32-19-12-17(26(36)34(25(19)33)16-5-3-15(28)4-6-16)20(35)11-14-2-7-21(18(29)10-14)37-22-8-9-31-24(30)23(22)27;1-32-14-31-21-13-19(26(35)33(25(21)32)17-5-3-16(27)4-6-17)22(34)11-15-2-7-23(20(28)10-15)36-18-8-9-30-24(29)12-18/h2*4-11,18,20-23H,3,12-17,19H2,1-2H3;3-13,15-17H,14H2,1-2H3;2-12,14-15H,13H2,1H3,(H,31,32);2-10,12-13H,11H2,1H3,(H2,30,31);2-10,12-14H,11H2,1H3,(H2,29,30)
InChIKeyNWPSBBQKGOQEEW-UHFFFAOYSA-N
XLogP31.68
TPSA612.98 Ų
H-Bond Donors3
H-Bond Acceptors53
Rotatable Bonds49
Heavy Atoms254
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003464.85
LogP ≤ 531.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1053

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;5-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-7-(4-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-6-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-3-methylimidazo[4,5-b]pyridin-5-one with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;5-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-7-(4-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-6-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-3-methylimidazo[4,5-b]pyridin-5-one?
The IUPAC name of 6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;5-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-7-(4-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-6-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-3-methylimidazo[4,5-b]pyridin-5-one (CID 159906320) is 6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;5-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-7-(4-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-6-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-3-methylimidazo[4,5-b]pyridin-5-one.
What is the SMILES notation for 6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;5-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-7-(4-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-6-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-3-methylimidazo[4,5-b]pyridin-5-one?
The canonical SMILES for 6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;5-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-7-(4-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-6-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-3-methylimidazo[4,5-b]pyridin-5-one is COc1cc2c(Oc3ccc(CC(=O)c4cc5cnn(C)c5n(-c5ccc(F)cc5)c4=O)cc3F)ccnc2cc1OCCCN1CCOCC1.COc1cc2c(Oc3ccc(CC(=O)c4cc5ncn(C)c5n(-c5ccc(F)cc5)c4=O)cc3F)ccnc2cc1OCCCN1CCOCC1.COc1ccc2c(Oc3ccc(CC(=O)c4cc5ncn(C)c5n(-c5ccc(F)cc5)c4=O)cc3F)ccnc2c1.Cn1cnc2cc(C(=O)Cc3ccc(Oc4ccnc(N)c4)c(F)c3)c(=O)n(-c3ccc(F)cc3)c21.Cn1cnc2cc(C(=O)Cc3ccc(Oc4ccnc(N)c4Cl)c(F)c3)c(=O)n(-c3ccc(F)cc3)c21.Cn1cnc2cc(C(=O)Cc3ccc(Oc4ccnc5[nH]ccc45)c(F)c3)c(=O)n(-c3ccc(F)cc3)c21.
What is the InChIKey of 6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;5-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-7-(4-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-6-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-3-methylimidazo[4,5-b]pyridin-5-one?
The InChIKey is NWPSBBQKGOQEEW-UHFFFAOYSA-N. The full InChI is InChI=1S/2C38H35F2N5O6.C31H22F2N4O4.C28H19F2N5O3.C26H18ClF2N5O3.C26H19F2N5O3/c1-43-37-25(23-42-43)20-29(38(47)45(37)27-7-5-26(39)6-8-27)32(46)19-24-4-9-34(30(40)18-24)51-33-10-11-41-31-22-36(35(48-2)21-28(31)33)50-15-3-12-44-13-16-49-17-14-44;1-43-23-42-31-20-28(38(47)45(37(31)43)26-7-5-25(39)6-8-26)32(46)19-24-4-9-34(29(40)18-24)51-33-10-11-41-30-22-36(35(48-2)21-27(30)33)50-15-3-12-44-13-16-49-17-14-44;1-36-17-35-26-16-23(31(39)37(30(26)36)20-6-4-19(32)5-7-20)27(38)14-18-3-10-29(24(33)13-18)41-28-11-12-34-25-15-21(40-2)8-9-22(25)28;1-34-15-33-22-14-20(28(37)35(27(22)34)18-5-3-17(29)4-6-18)23(36)13-16-2-7-25(21(30)12-16)38-24-9-11-32-26-19(24)8-10-31-26;1-33-13-32-19-12-17(26(36)34(25(19)33)16-5-3-15(28)4-6-16)20(35)11-14-2-7-21(18(29)10-14)37-22-8-9-31-24(30)23(22)27;1-32-14-31-21-13-19(26(35)33(25(21)32)17-5-3-16(27)4-6-17)22(34)11-15-2-7-23(20(28)10-15)36-18-8-9-30-24(29)12-18/h2*4-11,18,20-23H,3,12-17,19H2,1-2H3;3-13,15-17H,14H2,1-2H3;2-12,14-15H,13H2,1H3,(H,31,32);2-10,12-13H,11H2,1H3,(H2,30,31);2-10,12-14H,11H2,1H3,(H2,29,30).
What are the key properties of 6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;5-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-7-(4-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-6-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-3-methylimidazo[4,5-b]pyridin-5-one?
6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;5-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-7-(4-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-6-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-3-methylimidazo[4,5-b]pyridin-5-one has a molecular weight of 3464.85 g/mol, XLogP of 31.68, 49 rotatable bonds, 3 hydrogen bond donors, and 53 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;5-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-7-(4-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-6-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-3-methylimidazo[4,5-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-3-methylimidazo[4,5-b]pyridin-5-one is sourced from PubChem (CID 159906320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).