About 3-[2-[3-(4-acetylpiperazin-1-yl)propanoylamino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[3-(trifluoromethyl)phenyl]ethanone;3-[2-(cyclopropanecarbonylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-[4-piperidin-1-yl-3-(trifluoromethyl)phenyl]benzamide;6-(2,5-dimethylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine;3-[2-[[4-[(4-ethylpiperazin-1-yl)methyl]benzoyl]amino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;N-(3-methylphenyl)-3-[2-(3-piperazin-1-ylpropanoylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;N-(3-methylphenyl)-3-[2-(4-piperazin-1-ylsulfonylanilino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;bis(6-(3-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine)
3-[2-[3-(4-acetylpiperazin-1-yl)propanoylamino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[3-(trifluoromethyl)phenyl]ethanone;3-[2-(cyclopropanecarbonylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-[4-piperidin-1-yl-3-(trifluoromethyl)phenyl]benzamide;6-(2,5-dimethylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine;3-[2-[[4-[(4-ethylpiperazin-1-yl)methyl]benzoyl]amino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;N-(3-methylphenyl)-3-[2-(3-piperazin-1-ylpropanoylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;N-(3-methylphenyl)-3-[2-(4-piperazin-1-ylsulfonylanilino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;bis(6-(3-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine) (PubChem CID 159082860) has the molecular formula C211H197F6N41O13S10
and a molecular weight of 3949.83 g/mol. Its IUPAC name is 3-[2-[3-(4-acetylpiperazin-1-yl)propanoylamino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[3-(trifluoromethyl)phenyl]ethanone;3-[2-(cyclopropanecarbonylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-[4-piperidin-1-yl-3-(trifluoromethyl)phenyl]benzamide;6-(2,5-dimethylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine;3-[2-[[4-[(4-ethylpiperazin-1-yl)methyl]benzoyl]amino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;N-(3-methylphenyl)-3-[2-(3-piperazin-1-ylpropanoylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;N-(3-methylphenyl)-3-[2-(4-piperazin-1-ylsulfonylanilino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;bis(6-(3-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine).
Frequently Asked Questions
What is the IUPAC name of 3-[2-[3-(4-acetylpiperazin-1-yl)propanoylamino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[3-(trifluoromethyl)phenyl]ethanone;3-[2-(cyclopropanecarbonylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-[4-piperidin-1-yl-3-(trifluoromethyl)phenyl]benzamide;6-(2,5-dimethylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine;3-[2-[[4-[(4-ethylpiperazin-1-yl)methyl]benzoyl]amino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;N-(3-methylphenyl)-3-[2-(3-piperazin-1-ylpropanoylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;N-(3-methylphenyl)-3-[2-(4-piperazin-1-ylsulfonylanilino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;bis(6-(3-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine)?
The IUPAC name of 3-[2-[3-(4-acetylpiperazin-1-yl)propanoylamino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[3-(trifluoromethyl)phenyl]ethanone;3-[2-(cyclopropanecarbonylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-[4-piperidin-1-yl-3-(trifluoromethyl)phenyl]benzamide;6-(2,5-dimethylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine;3-[2-[[4-[(4-ethylpiperazin-1-yl)methyl]benzoyl]amino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;N-(3-methylphenyl)-3-[2-(3-piperazin-1-ylpropanoylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;N-(3-methylphenyl)-3-[2-(4-piperazin-1-ylsulfonylanilino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;bis(6-(3-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine) (CID 159082860) is 3-[2-[3-(4-acetylpiperazin-1-yl)propanoylamino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[3-(trifluoromethyl)phenyl]ethanone;3-[2-(cyclopropanecarbonylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-[4-piperidin-1-yl-3-(trifluoromethyl)phenyl]benzamide;6-(2,5-dimethylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine;3-[2-[[4-[(4-ethylpiperazin-1-yl)methyl]benzoyl]amino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;N-(3-methylphenyl)-3-[2-(3-piperazin-1-ylpropanoylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;N-(3-methylphenyl)-3-[2-(4-piperazin-1-ylsulfonylanilino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;bis(6-(3-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine).
What is the SMILES notation for 3-[2-[3-(4-acetylpiperazin-1-yl)propanoylamino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[3-(trifluoromethyl)phenyl]ethanone;3-[2-(cyclopropanecarbonylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-[4-piperidin-1-yl-3-(trifluoromethyl)phenyl]benzamide;6-(2,5-dimethylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine;3-[2-[[4-[(4-ethylpiperazin-1-yl)methyl]benzoyl]amino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;N-(3-methylphenyl)-3-[2-(3-piperazin-1-ylpropanoylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;N-(3-methylphenyl)-3-[2-(4-piperazin-1-ylsulfonylanilino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;bis(6-(3-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine)?
The canonical SMILES for 3-[2-[3-(4-acetylpiperazin-1-yl)propanoylamino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[3-(trifluoromethyl)phenyl]ethanone;3-[2-(cyclopropanecarbonylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-[4-piperidin-1-yl-3-(trifluoromethyl)phenyl]benzamide;6-(2,5-dimethylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine;3-[2-[[4-[(4-ethylpiperazin-1-yl)methyl]benzoyl]amino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;N-(3-methylphenyl)-3-[2-(3-piperazin-1-ylpropanoylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;N-(3-methylphenyl)-3-[2-(4-piperazin-1-ylsulfonylanilino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;bis(6-(3-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine) is CC(=O)N1CCN(CCC(=O)Nc2nc3ccc(-c4cccc(C(=O)Nc5cccc(C)c5)c4)nc3s2)CC1.CCN1CCN(Cc2ccc(C(=O)Nc3nc4ccc(-c5cccc(C(=O)Nc6cccc(C)c6)c5)nc4s3)cc2)CC1.Cc1ccc(C(=O)Cc2cccc(C(F)(F)F)c2)cc1-c1cnc2sc(N)nc2c1.Cc1ccc(C)c(-c2cnc3sc(N)nc3c2)c1.Cc1cccc(-c2cnc3sc(N)nc3c2)c1.Cc1cccc(-c2cnc3sc(N)nc3c2)c1.Cc1cccc(NC(=O)c2cccc(-c3ccc4nc(NC(=O)CCN5CCNCC5)sc4n3)c2)c1.Cc1cccc(NC(=O)c2cccc(-c3ccc4nc(Nc5ccc(S(=O)(=O)N6CCNCC6)cc5)sc4n3)c2)c1.O=C(Nc1ccc(N2CCCCC2)c(C(F)(F)F)c1)c1cccc(-c2ccc3nc(NC(=O)C4CC4)sc3n2)c1.
What is the InChIKey of 3-[2-[3-(4-acetylpiperazin-1-yl)propanoylamino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[3-(trifluoromethyl)phenyl]ethanone;3-[2-(cyclopropanecarbonylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-[4-piperidin-1-yl-3-(trifluoromethyl)phenyl]benzamide;6-(2,5-dimethylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine;3-[2-[[4-[(4-ethylpiperazin-1-yl)methyl]benzoyl]amino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;N-(3-methylphenyl)-3-[2-(3-piperazin-1-ylpropanoylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;N-(3-methylphenyl)-3-[2-(4-piperazin-1-ylsulfonylanilino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;bis(6-(3-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine)?
The InChIKey is KBBOLFJMUFJJEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H34N6O2S.C30H28N6O3S2.C29H26F3N5O2S.C29H30N6O3S.C27H28N6O2S.C22H16F3N3OS.C14H13N3S.2C13H11N3S/c1-3-39-16-18-40(19-17-39)22-24-10-12-25(13-11-24)31(41)38-34-37-30-15-14-29(36-33(30)43-34)26-7-5-8-27(21-26)32(42)35-28-9-4-6-23(2)20-28;1-20-4-2-7-24(18-20)32-28(37)22-6-3-5-21(19-22)26-12-13-27-29(34-26)40-30(35-27)33-23-8-10-25(11-9-23)41(38,39)36-16-14-31-15-17-36;30-29(31,32)21-16-20(9-12-24(21)37-13-2-1-3-14-37)33-26(39)19-6-4-5-18(15-19)22-10-11-23-27(34-22)40-28(35-23)36-25(38)17-7-8-17;1-19-5-3-8-23(17-19)30-27(38)22-7-4-6-21(18-22)24-9-10-25-28(31-24)39-29(32-25)33-26(37)11-12-34-13-15-35(16-14-34)20(2)36;1-18-4-2-7-21(16-18)29-25(35)20-6-3-5-19(17-20)22-8-9-23-26(30-22)36-27(31-23)32-24(34)10-13-33-14-11-28-12-15-33;1-12-5-6-14(19(29)8-13-3-2-4-16(7-13)22(23,24)25)9-17(12)15-10-18-20(27-11-15)30-21(26)28-18;1-8-3-4-9(2)11(5-8)10-6-12-13(16-7-10)18-14(15)17-12;2*1-8-3-2-4-9(5-8)10-6-11-12(15-7-10)17-13(14)16-11/h4-15,20-21H,3,16-19,22H2,1-2H3,(H,35,42)(H,37,38,41);2-13,18-19,31H,14-17H2,1H3,(H,32,37)(H,33,35);4-6,9-12,15-17H,1-3,7-8,13-14H2,(H,33,39)(H,35,36,38);3-10,17-18H,11-16H2,1-2H3,(H,30,38)(H,32,33,37);2-9,16-17,28H,10-15H2,1H3,(H,29,35)(H,31,32,34);2-7,9-11H,8H2,1H3,(H2,26,28);3-7H,1-2H3,(H2,15,17);2*2-7H,1H3,(H2,14,16).
What are the key properties of 3-[2-[3-(4-acetylpiperazin-1-yl)propanoylamino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[3-(trifluoromethyl)phenyl]ethanone;3-[2-(cyclopropanecarbonylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-[4-piperidin-1-yl-3-(trifluoromethyl)phenyl]benzamide;6-(2,5-dimethylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine;3-[2-[[4-[(4-ethylpiperazin-1-yl)methyl]benzoyl]amino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;N-(3-methylphenyl)-3-[2-(3-piperazin-1-ylpropanoylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;N-(3-methylphenyl)-3-[2-(4-piperazin-1-ylsulfonylanilino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;bis(6-(3-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine)?
3-[2-[3-(4-acetylpiperazin-1-yl)propanoylamino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[3-(trifluoromethyl)phenyl]ethanone;3-[2-(cyclopropanecarbonylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-[4-piperidin-1-yl-3-(trifluoromethyl)phenyl]benzamide;6-(2,5-dimethylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine;3-[2-[[4-[(4-ethylpiperazin-1-yl)methyl]benzoyl]amino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;N-(3-methylphenyl)-3-[2-(3-piperazin-1-ylpropanoylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;N-(3-methylphenyl)-3-[2-(4-piperazin-1-ylsulfonylanilino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;bis(6-(3-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine) has a molecular weight of 3949.83 g/mol, XLogP of 42.85, 42 rotatable bonds, 16 hydrogen bond donors, and 52 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[3-(4-acetylpiperazin-1-yl)propanoylamino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[3-(trifluoromethyl)phenyl]ethanone;3-[2-(cyclopropanecarbonylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-[4-piperidin-1-yl-3-(trifluoromethyl)phenyl]benzamide;6-(2,5-dimethylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine;3-[2-[[4-[(4-ethylpiperazin-1-yl)methyl]benzoyl]amino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-N-(3-methylphenyl)benzamide;N-(3-methylphenyl)-3-[2-(3-piperazin-1-ylpropanoylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;N-(3-methylphenyl)-3-[2-(4-piperazin-1-ylsulfonylanilino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]benzamide;bis(6-(3-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine) is sourced from PubChem (CID 159082860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).