1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide;3-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;4-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;3-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;6-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide;5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-2-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-4-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide

C157H117F2N37O18S10 — CID 167659670

IUPAC1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide;3-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;4-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;3-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;6-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide;5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-2-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-4-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide
SMILESCOc1ccc(C(=O)Nc2nc(-c3ccccn3)cs2)cn1.COc1cccc(C(=O)Nc2nc(-c3ccccn3)cs2)c1.Cc1cc(C(=O)Nc2nc(-c3ccccn3)cs2)no1.O=C(Nc1nc(-c2ccccn2)cs1)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1.O=C(Nc1nc(-c2ccccn2)cs1)C1COc2ccccc2O1.O=C(Nc1nc(-c2ccccn2)cs1)c1ccc(F)cc1.O=C(Nc1nc(-c2ccccn2)cs1)c1ccc2nccnc2c1.O=C(Nc1nc(-c2ccccn2)cs1)c1cccc(F)c1.O=C(Nc1nc(-c2ccccn2)cs1)c1ccccn1.O=C(Nc1nc(-c2ccccn2)cs1)c1ccncc1
InChIInChI=1S/C21H18N4O4S.C17H11N5OS.C17H13N3O3S.C16H13N3O2S.2C15H10FN3OS.C15H12N4O2S.2C14H10N4OS.C13H10N4O2S/c26-19-9-13(11-25(19)14-4-5-17-18(10-14)29-8-7-28-17)20(27)24-21-23-16(12-30-21)15-3-1-2-6-22-15;23-16(11-4-5-13-14(9-11)20-8-7-19-13)22-17-21-15(10-24-17)12-3-1-2-6-18-12;21-16(15-9-22-13-6-1-2-7-14(13)23-15)20-17-19-12(10-24-17)11-5-3-4-8-18-11;1-21-12-6-4-5-11(9-12)15(20)19-16-18-14(10-22-16)13-7-2-3-8-17-13;16-11-5-3-4-10(8-11)14(20)19-15-18-13(9-21-15)12-6-1-2-7-17-12;16-11-6-4-10(5-7-11)14(20)19-15-18-13(9-21-15)12-3-1-2-8-17-12;1-21-13-6-5-10(8-17-13)14(20)19-15-18-12(9-22-15)11-4-2-3-7-16-11;19-13(11-6-2-4-8-16-11)18-14-17-12(9-20-14)10-5-1-3-7-15-10;19-13(10-4-7-15-8-5-10)18-14-17-12(9-20-14)11-3-1-2-6-16-11;1-8-6-10(17-19-8)12(18)16-13-15-11(7-20-13)9-4-2-3-5-14-9/h1-6,10,12-13H,7-9,11H2,(H,23,24,27);1-10H,(H,21,22,23);1-8,10,15H,9H2,(H,19,20,21);2-10H,1H3,(H,18,19,20);2*1-9H,(H,18,19,20);2-9H,1H3,(H,18,19,20);2*1-9H,(H,17,18,19);2-7H,1H3,(H,15,16,18)
InChIKeyRTUAEGBRPSATIZ-UHFFFAOYSA-N
MW3168.57 g/mol
LogP31.33
Rot. Bonds33

About 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide;3-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;4-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;3-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;6-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide;5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-2-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-4-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide

1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide;3-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;4-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;3-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;6-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide;5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-2-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-4-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide (PubChem CID 167659670) has the molecular formula C157H117F2N37O18S10 and a molecular weight of 3168.57 g/mol. Its IUPAC name is 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide;3-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;4-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;3-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;6-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide;5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-2-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-4-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide.

Molecular Properties

Compound Name1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide;3-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;4-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;3-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;6-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide;5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-2-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-4-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide
PubChem CID167659670
Molecular FormulaC157H117F2N37O18S10
Molecular Weight3168.57 g/mol
Exact Mass3165.66
IUPAC Name1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide;3-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;4-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;3-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;6-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide;5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-2-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-4-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide
SMILESCOc1ccc(C(=O)Nc2nc(-c3ccccn3)cs2)cn1.COc1cccc(C(=O)Nc2nc(-c3ccccn3)cs2)c1.Cc1cc(C(=O)Nc2nc(-c3ccccn3)cs2)no1.O=C(Nc1nc(-c2ccccn2)cs1)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1.O=C(Nc1nc(-c2ccccn2)cs1)C1COc2ccccc2O1.O=C(Nc1nc(-c2ccccn2)cs1)c1ccc(F)cc1.O=C(Nc1nc(-c2ccccn2)cs1)c1ccc2nccnc2c1.O=C(Nc1nc(-c2ccccn2)cs1)c1cccc(F)c1.O=C(Nc1nc(-c2ccccn2)cs1)c1ccccn1.O=C(Nc1nc(-c2ccccn2)cs1)c1ccncc1
InChIInChI=1S/C21H18N4O4S.C17H11N5OS.C17H13N3O3S.C16H13N3O2S.2C15H10FN3OS.C15H12N4O2S.2C14H10N4OS.C13H10N4O2S/c26-19-9-13(11-25(19)14-4-5-17-18(10-14)29-8-7-28-17)20(27)24-21-23-16(12-30-21)15-3-1-2-6-22-15;23-16(11-4-5-13-14(9-11)20-8-7-19-13)22-17-21-15(10-24-17)12-3-1-2-6-18-12;21-16(15-9-22-13-6-1-2-7-14(13)23-15)20-17-19-12(10-24-17)11-5-3-4-8-18-11;1-21-12-6-4-5-11(9-12)15(20)19-16-18-14(10-22-16)13-7-2-3-8-17-13;16-11-5-3-4-10(8-11)14(20)19-15-18-13(9-21-15)12-6-1-2-7-17-12;16-11-6-4-10(5-7-11)14(20)19-15-18-13(9-21-15)12-3-1-2-8-17-12;1-21-13-6-5-10(8-17-13)14(20)19-15-18-12(9-22-15)11-4-2-3-7-16-11;19-13(11-6-2-4-8-16-11)18-14-17-12(9-20-14)10-5-1-3-7-15-10;19-13(10-4-7-15-8-5-10)18-14-17-12(9-20-14)11-3-1-2-6-16-11;1-8-6-10(17-19-8)12(18)16-13-15-11(7-20-13)9-4-2-3-5-14-9/h1-6,10,12-13H,7-9,11H2,(H,23,24,27);1-10H,(H,21,22,23);1-8,10,15H,9H2,(H,19,20,21);2-10H,1H3,(H,18,19,20);2*1-9H,(H,18,19,20);2-9H,1H3,(H,18,19,20);2*1-9H,(H,17,18,19);2-7H,1H3,(H,15,16,18)
InChIKeyRTUAEGBRPSATIZ-UHFFFAOYSA-N
XLogP31.33
TPSA714.97 Ų
H-Bond Donors10
H-Bond Acceptors54
Rotatable Bonds33
Heavy Atoms224
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003168.57
LogP ≤ 531.33
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1054

Analyze 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide;3-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;4-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;3-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;6-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide;5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-2-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-4-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide with MolForge

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Related Compounds

1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide;2-(3-fluorophenyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide;4-(methylsulfonylmethyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;2-(2-oxoquinoxalin-1-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-3H-benzimidazole-5-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-4-carboxamide
CID 157290946
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide;2-(3-fluorophenyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide;1-(3H-indol-6-yl)-2-(4-pyridin-2-yl-1,3-thiazol-2-yl)ethanone;3-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1-benzofuran-2-carboxamide;4-(methylsulfonylmethyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;2-(4-oxoquinazolin-3-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide;2-(2-oxoquinoxalin-1-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-4-carboxamide
CID 157964153
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide;3-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;4-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;3-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;6-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide;5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-2-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-4-carboxamide;2-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1-quinoxalin-6-ylethanone
CID 158516259
3-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;4-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;3-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;6-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide;5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-2-carboxamide;2-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1-quinoxalin-6-ylethanone
CID 158996267
3-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;4-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;3-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;6-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide;5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-2-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide
CID 159587679
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide;2-(3-fluorophenyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide;1-(3H-indol-6-yl)-2-(4-pyridin-2-yl-1,3-thiazol-2-yl)ethanone;4-(methylsulfonylmethyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;2-(4-oxoquinazolin-3-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide;2-(2-oxoquinoxalin-1-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-4-carboxamide
CID 159701244
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide;3-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;4-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;3-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;6-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide;5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-2-carboxamide;2-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1-quinoxalin-6-ylethanone
CID 162224632
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide;3-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;4-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;1-(3-methoxyphenyl)-2-(4-pyridin-2-yl-1,3-thiazol-2-yl)ethanone;6-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide;5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-2-carboxamide;2-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1-quinoxalin-6-ylethanone
CID 163627405

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide;3-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;4-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;3-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;6-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide;5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-2-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-4-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide?
The IUPAC name of 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide;3-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;4-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;3-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;6-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide;5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-2-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-4-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide (CID 167659670) is 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide;3-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;4-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;3-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;6-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide;5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-2-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-4-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide.
What is the SMILES notation for 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide;3-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;4-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;3-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;6-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide;5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-2-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-4-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide?
The canonical SMILES for 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide;3-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;4-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;3-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;6-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide;5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-2-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-4-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide is COc1ccc(C(=O)Nc2nc(-c3ccccn3)cs2)cn1.COc1cccc(C(=O)Nc2nc(-c3ccccn3)cs2)c1.Cc1cc(C(=O)Nc2nc(-c3ccccn3)cs2)no1.O=C(Nc1nc(-c2ccccn2)cs1)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1.O=C(Nc1nc(-c2ccccn2)cs1)C1COc2ccccc2O1.O=C(Nc1nc(-c2ccccn2)cs1)c1ccc(F)cc1.O=C(Nc1nc(-c2ccccn2)cs1)c1ccc2nccnc2c1.O=C(Nc1nc(-c2ccccn2)cs1)c1cccc(F)c1.O=C(Nc1nc(-c2ccccn2)cs1)c1ccccn1.O=C(Nc1nc(-c2ccccn2)cs1)c1ccncc1.
What is the InChIKey of 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide;3-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;4-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;3-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;6-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide;5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-2-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-4-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide?
The InChIKey is RTUAEGBRPSATIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O4S.C17H11N5OS.C17H13N3O3S.C16H13N3O2S.2C15H10FN3OS.C15H12N4O2S.2C14H10N4OS.C13H10N4O2S/c26-19-9-13(11-25(19)14-4-5-17-18(10-14)29-8-7-28-17)20(27)24-21-23-16(12-30-21)15-3-1-2-6-22-15;23-16(11-4-5-13-14(9-11)20-8-7-19-13)22-17-21-15(10-24-17)12-3-1-2-6-18-12;21-16(15-9-22-13-6-1-2-7-14(13)23-15)20-17-19-12(10-24-17)11-5-3-4-8-18-11;1-21-12-6-4-5-11(9-12)15(20)19-16-18-14(10-22-16)13-7-2-3-8-17-13;16-11-5-3-4-10(8-11)14(20)19-15-18-13(9-21-15)12-6-1-2-7-17-12;16-11-6-4-10(5-7-11)14(20)19-15-18-13(9-21-15)12-3-1-2-8-17-12;1-21-13-6-5-10(8-17-13)14(20)19-15-18-12(9-22-15)11-4-2-3-7-16-11;19-13(11-6-2-4-8-16-11)18-14-17-12(9-20-14)10-5-1-3-7-15-10;19-13(10-4-7-15-8-5-10)18-14-17-12(9-20-14)11-3-1-2-6-16-11;1-8-6-10(17-19-8)12(18)16-13-15-11(7-20-13)9-4-2-3-5-14-9/h1-6,10,12-13H,7-9,11H2,(H,23,24,27);1-10H,(H,21,22,23);1-8,10,15H,9H2,(H,19,20,21);2-10H,1H3,(H,18,19,20);2*1-9H,(H,18,19,20);2-9H,1H3,(H,18,19,20);2*1-9H,(H,17,18,19);2-7H,1H3,(H,15,16,18).
What are the key properties of 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide;3-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;4-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;3-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;6-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide;5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-2-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-4-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide?
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide;3-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;4-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;3-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;6-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide;5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-2-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-4-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide has a molecular weight of 3168.57 g/mol, XLogP of 31.33, 33 rotatable bonds, 10 hydrogen bond donors, and 54 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide;3-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;4-fluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;3-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide;6-methoxy-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide;5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-2-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-4-carboxamide;N-(4-pyridin-2-yl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide is sourced from PubChem (CID 167659670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).