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

C234H155ClF16N34O28S10 — CID 160565051

IUPAC6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[2-(1-ethylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxy-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[(3-methyl-2H-pyrazolo[3,4-b]pyridin-4-yl)oxy]phenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-[1,3]thiazolo[5,4-b]pyridin-5-one
SMILESCCn1cnc(-c2cc3nccc(Oc4ccc(CC(=O)c5cc6ncsc6n(-c6ccc(F)cc6)c5=O)cc4F)c3s2)c1.COc1cc2c(Oc3ccc(CC(=O)c4cc5ncsc5n(-c5ccc(F)cc5)c4=O)cc3F)ccnc2cc1OCCCN1CCOCC1.COc1ccc2c(Oc3ccc(CC(=O)c4cc5ncsc5n(-c5ccc(F)cc5)c4=O)cc3F)ccnc2c1.Cc1[nH]nc2nccc(Oc3ccc(CC(=O)c4cc5ncsc5n(-c5ccc(F)cc5)c4=O)cc3F)c12.Cn1cnc(-c2cc3nccc(Oc4ccc(CC(=O)c5cc6ncsc6n(-c6ccc(F)cc6)c5=O)cc4F)c3s2)c1.Nc1cc(Oc2ccc(CC(=O)c3cc4ncsc4n(-c4ccc(F)cc4)c3=O)cc2F)ccn1.Nc1nccc(Oc2ccc(CC(=O)c3cc4ncsc4n(-c4ccc(F)cc4)c3=O)cc2F)c1Cl.O=C(Cc1ccc(Oc2ccnc3[nH]ccc23)c(F)c1)c1cc2ncsc2n(-c2ccc(F)cc2)c1=O
InChIInChI=1S/C37H32F2N4O6S.C32H21F2N5O3S2.C31H19F2N5O3S2.C30H19F2N3O4S.C27H17F2N5O3S.C27H16F2N4O3S.C25H15ClF2N4O3S.C25H16F2N4O3S/c1-46-34-20-26-29(21-35(34)48-14-2-11-42-12-15-47-16-13-42)40-10-9-32(26)49-33-8-3-23(17-28(33)39)18-31(44)27-19-30-37(50-22-41-30)43(36(27)45)25-6-4-24(38)5-7-25;1-2-38-15-25(36-16-38)29-14-23-30(44-29)28(9-10-35-23)42-27-8-3-18(11-22(27)34)12-26(40)21-13-24-32(43-17-37-24)39(31(21)41)20-6-4-19(33)5-7-20;1-37-14-24(35-15-37)28-13-22-29(43-28)27(8-9-34-22)41-26-7-2-17(10-21(26)33)11-25(39)20-12-23-31(42-16-36-23)38(30(20)40)19-5-3-18(32)4-6-19;1-38-20-7-8-21-24(14-20)33-11-10-27(21)39-28-9-2-17(12-23(28)32)13-26(36)22-15-25-30(40-16-34-25)35(29(22)37)19-5-3-18(31)4-6-19;1-14-24-23(8-9-30-25(24)33-32-14)37-22-7-2-15(10-19(22)29)11-21(35)18-12-20-27(38-13-31-20)34(26(18)36)17-5-3-16(28)4-6-17;28-16-2-4-17(5-3-16)33-26(35)19(13-21-27(33)37-14-32-21)22(34)12-15-1-6-24(20(29)11-15)36-23-8-10-31-25-18(23)7-9-30-25;26-22-21(7-8-30-23(22)29)35-20-6-1-13(9-17(20)28)10-19(33)16-11-18-25(36-12-31-18)32(24(16)34)15-4-2-14(27)3-5-15;26-15-2-4-16(5-3-15)31-24(33)18(12-20-25(31)35-13-30-20)21(32)10-14-1-6-22(19(27)9-14)34-17-7-8-29-23(28)11-17/h3-10,17,19-22H,2,11-16,18H2,1H3;3-11,13-17H,2,12H2,1H3;2-10,12-16H,11H2,1H3;2-12,14-16H,13H2,1H3;2-10,12-13H,11H2,1H3,(H,30,32,33);1-11,13-14H,12H2,(H,30,31);1-9,11-12H,10H2,(H2,29,30);1-9,11-13H,10H2,(H2,28,29)
InChIKeyQZUQJBFYRSZBOG-UHFFFAOYSA-N
MW4551.11 g/mol
LogP49.33
Rot. Bonds58

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

6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[2-(1-ethylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxy-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[(3-methyl-2H-pyrazolo[3,4-b]pyridin-4-yl)oxy]phenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-[1,3]thiazolo[5,4-b]pyridin-5-one (PubChem CID 160565051) has the molecular formula C234H155ClF16N34O28S10 and a molecular weight of 4551.11 g/mol. Its IUPAC name is 6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[2-(1-ethylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxy-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[(3-methyl-2H-pyrazolo[3,4-b]pyridin-4-yl)oxy]phenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-[1,3]thiazolo[5,4-b]pyridin-5-one.

Molecular Properties

Compound Name6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[2-(1-ethylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxy-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[(3-methyl-2H-pyrazolo[3,4-b]pyridin-4-yl)oxy]phenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-[1,3]thiazolo[5,4-b]pyridin-5-one
PubChem CID160565051
Molecular FormulaC234H155ClF16N34O28S10
Molecular Weight4551.11 g/mol
Exact Mass4546.84
IUPAC Name6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[2-(1-ethylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxy-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[(3-methyl-2H-pyrazolo[3,4-b]pyridin-4-yl)oxy]phenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-[1,3]thiazolo[5,4-b]pyridin-5-one
SMILESCCn1cnc(-c2cc3nccc(Oc4ccc(CC(=O)c5cc6ncsc6n(-c6ccc(F)cc6)c5=O)cc4F)c3s2)c1.COc1cc2c(Oc3ccc(CC(=O)c4cc5ncsc5n(-c5ccc(F)cc5)c4=O)cc3F)ccnc2cc1OCCCN1CCOCC1.COc1ccc2c(Oc3ccc(CC(=O)c4cc5ncsc5n(-c5ccc(F)cc5)c4=O)cc3F)ccnc2c1.Cc1[nH]nc2nccc(Oc3ccc(CC(=O)c4cc5ncsc5n(-c5ccc(F)cc5)c4=O)cc3F)c12.Cn1cnc(-c2cc3nccc(Oc4ccc(CC(=O)c5cc6ncsc6n(-c6ccc(F)cc6)c5=O)cc4F)c3s2)c1.Nc1cc(Oc2ccc(CC(=O)c3cc4ncsc4n(-c4ccc(F)cc4)c3=O)cc2F)ccn1.Nc1nccc(Oc2ccc(CC(=O)c3cc4ncsc4n(-c4ccc(F)cc4)c3=O)cc2F)c1Cl.O=C(Cc1ccc(Oc2ccnc3[nH]ccc23)c(F)c1)c1cc2ncsc2n(-c2ccc(F)cc2)c1=O
InChIInChI=1S/C37H32F2N4O6S.C32H21F2N5O3S2.C31H19F2N5O3S2.C30H19F2N3O4S.C27H17F2N5O3S.C27H16F2N4O3S.C25H15ClF2N4O3S.C25H16F2N4O3S/c1-46-34-20-26-29(21-35(34)48-14-2-11-42-12-15-47-16-13-42)40-10-9-32(26)49-33-8-3-23(17-28(33)39)18-31(44)27-19-30-37(50-22-41-30)43(36(27)45)25-6-4-24(38)5-7-25;1-2-38-15-25(36-16-38)29-14-23-30(44-29)28(9-10-35-23)42-27-8-3-18(11-22(27)34)12-26(40)21-13-24-32(43-17-37-24)39(31(21)41)20-6-4-19(33)5-7-20;1-37-14-24(35-15-37)28-13-22-29(43-28)27(8-9-34-22)41-26-7-2-17(10-21(26)33)11-25(39)20-12-23-31(42-16-36-23)38(30(20)40)19-5-3-18(32)4-6-19;1-38-20-7-8-21-24(14-20)33-11-10-27(21)39-28-9-2-17(12-23(28)32)13-26(36)22-15-25-30(40-16-34-25)35(29(22)37)19-5-3-18(31)4-6-19;1-14-24-23(8-9-30-25(24)33-32-14)37-22-7-2-15(10-19(22)29)11-21(35)18-12-20-27(38-13-31-20)34(26(18)36)17-5-3-16(28)4-6-17;28-16-2-4-17(5-3-16)33-26(35)19(13-21-27(33)37-14-32-21)22(34)12-15-1-6-24(20(29)11-15)36-23-8-10-31-25-18(23)7-9-30-25;26-22-21(7-8-30-23(22)29)35-20-6-1-13(9-17(20)28)10-19(33)16-11-18-25(36-12-31-18)32(24(16)34)15-4-2-14(27)3-5-15;26-15-2-4-16(5-3-15)31-24(33)18(12-20-25(31)35-13-30-20)21(32)10-14-1-6-22(19(27)9-14)34-17-7-8-29-23(28)11-17/h3-10,17,19-22H,2,11-16,18H2,1H3;3-11,13-17H,2,12H2,1H3;2-10,12-16H,11H2,1H3;2-12,14-16H,13H2,1H3;2-10,12-13H,11H2,1H3,(H,30,32,33);1-11,13-14H,12H2,(H,30,31);1-9,11-12H,10H2,(H2,29,30);1-9,11-13H,10H2,(H2,28,29)
InChIKeyQZUQJBFYRSZBOG-UHFFFAOYSA-N
XLogP49.33
TPSA764.95 Ų
H-Bond Donors4
H-Bond Acceptors70
Rotatable Bonds58
Heavy Atoms323
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004551.11
LogP ≤ 549.33
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1070

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

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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)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[2-(1-ethylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxy-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[(3-methyl-2H-pyrazolo[3,4-b]pyridin-4-yl)oxy]phenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-[1,3]thiazolo[5,4-b]pyridin-5-one?
The IUPAC name of 6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[2-(1-ethylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxy-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[(3-methyl-2H-pyrazolo[3,4-b]pyridin-4-yl)oxy]phenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-[1,3]thiazolo[5,4-b]pyridin-5-one (CID 160565051) is 6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[2-(1-ethylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxy-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[(3-methyl-2H-pyrazolo[3,4-b]pyridin-4-yl)oxy]phenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-[1,3]thiazolo[5,4-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)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[2-(1-ethylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxy-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[(3-methyl-2H-pyrazolo[3,4-b]pyridin-4-yl)oxy]phenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-[1,3]thiazolo[5,4-b]pyridin-5-one?
The canonical SMILES for 6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[2-(1-ethylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxy-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[(3-methyl-2H-pyrazolo[3,4-b]pyridin-4-yl)oxy]phenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-[1,3]thiazolo[5,4-b]pyridin-5-one is CCn1cnc(-c2cc3nccc(Oc4ccc(CC(=O)c5cc6ncsc6n(-c6ccc(F)cc6)c5=O)cc4F)c3s2)c1.COc1cc2c(Oc3ccc(CC(=O)c4cc5ncsc5n(-c5ccc(F)cc5)c4=O)cc3F)ccnc2cc1OCCCN1CCOCC1.COc1ccc2c(Oc3ccc(CC(=O)c4cc5ncsc5n(-c5ccc(F)cc5)c4=O)cc3F)ccnc2c1.Cc1[nH]nc2nccc(Oc3ccc(CC(=O)c4cc5ncsc5n(-c5ccc(F)cc5)c4=O)cc3F)c12.Cn1cnc(-c2cc3nccc(Oc4ccc(CC(=O)c5cc6ncsc6n(-c6ccc(F)cc6)c5=O)cc4F)c3s2)c1.Nc1cc(Oc2ccc(CC(=O)c3cc4ncsc4n(-c4ccc(F)cc4)c3=O)cc2F)ccn1.Nc1nccc(Oc2ccc(CC(=O)c3cc4ncsc4n(-c4ccc(F)cc4)c3=O)cc2F)c1Cl.O=C(Cc1ccc(Oc2ccnc3[nH]ccc23)c(F)c1)c1cc2ncsc2n(-c2ccc(F)cc2)c1=O.
What is the InChIKey of 6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[2-(1-ethylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxy-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[(3-methyl-2H-pyrazolo[3,4-b]pyridin-4-yl)oxy]phenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-[1,3]thiazolo[5,4-b]pyridin-5-one?
The InChIKey is QZUQJBFYRSZBOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H32F2N4O6S.C32H21F2N5O3S2.C31H19F2N5O3S2.C30H19F2N3O4S.C27H17F2N5O3S.C27H16F2N4O3S.C25H15ClF2N4O3S.C25H16F2N4O3S/c1-46-34-20-26-29(21-35(34)48-14-2-11-42-12-15-47-16-13-42)40-10-9-32(26)49-33-8-3-23(17-28(33)39)18-31(44)27-19-30-37(50-22-41-30)43(36(27)45)25-6-4-24(38)5-7-25;1-2-38-15-25(36-16-38)29-14-23-30(44-29)28(9-10-35-23)42-27-8-3-18(11-22(27)34)12-26(40)21-13-24-32(43-17-37-24)39(31(21)41)20-6-4-19(33)5-7-20;1-37-14-24(35-15-37)28-13-22-29(43-28)27(8-9-34-22)41-26-7-2-17(10-21(26)33)11-25(39)20-12-23-31(42-16-36-23)38(30(20)40)19-5-3-18(32)4-6-19;1-38-20-7-8-21-24(14-20)33-11-10-27(21)39-28-9-2-17(12-23(28)32)13-26(36)22-15-25-30(40-16-34-25)35(29(22)37)19-5-3-18(31)4-6-19;1-14-24-23(8-9-30-25(24)33-32-14)37-22-7-2-15(10-19(22)29)11-21(35)18-12-20-27(38-13-31-20)34(26(18)36)17-5-3-16(28)4-6-17;28-16-2-4-17(5-3-16)33-26(35)19(13-21-27(33)37-14-32-21)22(34)12-15-1-6-24(20(29)11-15)36-23-8-10-31-25-18(23)7-9-30-25;26-22-21(7-8-30-23(22)29)35-20-6-1-13(9-17(20)28)10-19(33)16-11-18-25(36-12-31-18)32(24(16)34)15-4-2-14(27)3-5-15;26-15-2-4-16(5-3-15)31-24(33)18(12-20-25(31)35-13-30-20)21(32)10-14-1-6-22(19(27)9-14)34-17-7-8-29-23(28)11-17/h3-10,17,19-22H,2,11-16,18H2,1H3;3-11,13-17H,2,12H2,1H3;2-10,12-16H,11H2,1H3;2-12,14-16H,13H2,1H3;2-10,12-13H,11H2,1H3,(H,30,32,33);1-11,13-14H,12H2,(H,30,31);1-9,11-12H,10H2,(H2,29,30);1-9,11-13H,10H2,(H2,28,29).
What are the key properties of 6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[2-(1-ethylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxy-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[(3-methyl-2H-pyrazolo[3,4-b]pyridin-4-yl)oxy]phenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-[1,3]thiazolo[5,4-b]pyridin-5-one?
6-[2-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[2-(1-ethylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxy-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[(3-methyl-2H-pyrazolo[3,4-b]pyridin-4-yl)oxy]phenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-[1,3]thiazolo[5,4-b]pyridin-5-one has a molecular weight of 4551.11 g/mol, XLogP of 49.33, 58 rotatable bonds, 4 hydrogen bond donors, and 70 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)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[4-[2-(1-ethylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxy-3-fluorophenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;6-[2-[3-fluoro-4-[(3-methyl-2H-pyrazolo[3,4-b]pyridin-4-yl)oxy]phenyl]acetyl]-4-(4-fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-5-one;4-(4-fluorophenyl)-6-[2-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]acetyl]-[1,3]thiazolo[5,4-b]pyridin-5-one is sourced from PubChem (CID 160565051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).