Basic Information |
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Product Name: | CHIR-99021 |
CAS: | 252917-06-9 |
English Synonyms: | CHIR99021 ; CHIR 911 ; CHIR-99021 ; 3-PYRIDINECARBONITRILE, 6-[[2-[[4-(2,4-DICHLOROPHENYL)-5-(5-METHYL-1H-IMIDAZOL-2-YL)-2-PYRIMIDINYL]AMINO]ETHYL]AMINO]- ; 6-(2-[4-(2,4-DICHLORO-PHENYL)-5-(5-METHYL-1H-IMIDAZOL-2-YL)-PYRIMIDIN-2-YLAMINO]-ETHYLAMINO)-NICOTINONITRILE ; 6-[[2-[[4-(2,4-DICHLOROPHENYL)-5-(5-METHYL-1H-IMIDAZOL-2-YL)-2-PYRIMIDINYL]AMINO]ETHYL]AMINO]-3-PYRIDINECARBONITRILE ; GSK-3 INHIBITOR XVI ; 6-[2-[4-(2,4-DICHLOROPHENYL)-5-(4-METHYL-1H-IMIDAZOL-2-YL)PYRIMIDIN-2-YLAMINO]ETHYLAMINO]PYRIDINE-3-CARBONITRILE ; 6-[(2-([4-(2,4-DICHLOROPHENYL)-5-(4-METHYLIMIDAZOL-2-YL)PYRIMIDIN-2-YL]AMINO)ETHYL)AMINO]PYRIDINE-3-CARBONITRILE |
MDL Number.: | MFCD12546133 |
H bond acceptor: | 8 |
H bond donor: | 3 |
Smile: | Cc1cnc([nH]1)c2cnc(nc2c3ccc(cc3Cl)Cl)NCCNc4ccc(cn4)C#N |
InChi: | InChI=1S/C22H18Cl2N8/c1-13-10-29-21(31-13)17-12-30-22(32-20(17)16-4-3-15(23)8-18(16)24)27-7-6-26-19-5-2-14(9-25)11-28-19/h2-5,8,10-12H,6-7H2,1H3,(H,26,28)(H,29,31)(H,27,30,32) |
InChiKey: | InChIKey=AQGNHMOJWBZFQQ-UHFFFAOYSA-N |
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