GSK-256066 (2,2,2-TRIFLUOROACETIC ACID)

CAS号
1415560-64-3
CCD编号
CCD07145182
分子式
C27 H26 N4 O5 S . C2 H F3 O2
分子量
632.613

基本信息

产品名称: GSK-256066 (2,2,2-TRIFLUOROACETIC ACID)
CAS: 1415560-64-3
英文同义词: GSK-256066 (2,2,2-TRIFLUOROACETIC ACID)
MDL号: MFCD22125307
氢键受体数量: 9
氢键供体数量: 2
Smile: Cc1cc(cc2c1ncc(c2Nc3cccc(c3)OC)C(=O)N)S(=O)(=O)c4cccc(c4)C(=O)N(C)C.C(=O)(C(F)(F)F)O
InChi: InChI=1S/C27H26N4O5S.C2HF3O2/c1-16-11-21(37(34,35)20-10-5-7-17(12-20)27(33)31(2)3)14-22-24(16)29-15-23(26(28)32)25(22)30-18-8-6-9-19(13-18)36-4;3-2(4,5)1(6)7/h5-15H,1-4H3,(H2,28,32)(H,29,30);(H,6,7)
InChiKey: InChIKey=PTTKEASHQDSBJR-UHFFFAOYSA-N

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