CB 3988

CAS No.
112888-26-3
CCD No.
CCD00179423
Formula
C26 H23 F3 N4 O6
MolWeight
544.484

Basic Information

Product Name: CB 3988
CAS: 112888-26-3
English Synonyms: CB 3988
MDL Number.: MFCD00898043
H bond acceptor: 10
H bond donor: 4
Smile: Cc1[nH]c(=O)c2cc(ccc2n1)CN(CC#C)c3ccc(c(c3)C(F)(F)F)C(=O)N[C@@H](CCC(=O)O)C(=O)O
InChi: InChI=1S/C26H23F3N4O6/c1-3-10-33(13-15-4-7-20-18(11-15)24(37)31-14(2)30-20)16-5-6-17(19(12-16)26(27,28)29)23(36)32-21(25(38)39)8-9-22(34)35/h1,4-7,11-12,21H,8-10,13H2,2H3,(H,32,36)(H,34,35)(H,38,39)(H,30,31,37)/t21-/m0/s1
InChiKey: InChIKey=QVJDQRGWHLSUHB-NRFANRHFSA-N

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