basic_info |
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| Product_Name: | 4-[4-(METHOXYCARBONYL)-3-METHYL-6-PHENYL-1H-PYRAZOLO[3,4-B]PYRIDIN-1-YL]BENZOIC ACID |
| CAS: | 1011398-75-6 |
| EnglishSynonyms: | 1-(4-CARBOXY-PHENYL)-3-METHYL-6-PHENYL-1H-PYRAZOLO[3,4-B]PYRIDINE-4-CARBOXYLIC ACID METHYL ESTER ; 4-[4-(METHOXYCARBONYL)-3-METHYL-6-PHENYL-1H-PYRAZOLO[3,4-B]PYRIDIN-1-YL]BENZOIC ACID |
| pro_mdlNumber: | MFCD09473501 |
| pro_acceptors: | 7 |
| pro_donors: | 1 |
| pro_smile: | Cc1c2c(cc(nc2n(n1)c3ccc(cc3)C(=O)O)c4ccccc4)C(=O)OC |
| InChi: | InChI=1S/C22H17N3O4/c1-13-19-17(22(28)29-2)12-18(14-6-4-3-5-7-14)23-20(19)25(24-13)16-10-8-15(9-11-16)21(26)27/h3-12H,1-2H3,(H,26,27) |
| InChiKey: | InChIKey=NWOLREUHAIPJIH-UHFFFAOYSA-N |
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