MLN8237 ,1028486-01-2 _Chemical Cloud Database

MLN8237

Basic Information
Product Name：	MLN8237
CAS：	1028486-01-2
English Synonyms：	4-[[9-CHLORO-7-(2-FLUORO-6-METHOXYPHENYL)-5H-PYRIMIDO[5,4-D][2]BENZAZEPIN-2-YL]AMINO]-2-METHOXYBENZOIC ACID ; MLN-8237 ; 4-((9-CHLORO-7-(2-FLUORO-6-METHOXYPHENYL)-5H-BENZO[C]PYRIMIDO[4,5-E]AZEPIN-2-YL)AMINO)-2-METHOXYBENZOIC ACID ; ALISERTIB ; MLN 8237, ; MLN8237 ; 4-([13-CHLORO-10-(2-FLUORO-6-METHOXYPHENYL)-3,5,9-TRIAZATRICYCLO[9.4.0.0(2,7)]PENTADECA-1(11),2(7),3,5,9,12,14-HEPTAEN-4-YL]AMINO)-2-METHOXYBENZOIC ACID ; ALISERTIB (MLN8237)
MDL Number.：	MFCD16621243
H bond acceptor：	8
H bond donor：	2
Smile：	COc1cccc(c1C2=NCc3cnc(nc3-c4c2cc(cc4)Cl)Nc5ccc(c(c5)OC)C(=O)O)F
InChi：	InChI=1S/C27H20ClFN4O4/c1-36-21-5-3-4-20(29)23(21)25-19-10-15(28)6-8-17(19)24-14(12-30-25)13-31-27(33-24)32-16-7-9-18(26(34)35)22(11-16)37-2/h3-11,13H,12H2,1-2H3,(H,34,35)(H,31,32,33)
InChiKey：	InChIKey=ZLHFILGSQDJULK-UHFFFAOYSA-N
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