CP-346086 DIHYDRATE

CAS No.
186390-48-7
CCD No.
CCD03478470
Formula
C26 H22 F3 N5 O . 2 H2 O
MolWeight
513.517

Basic Information

Product Name: CP-346086 DIHYDRATE
CAS: 186390-48-7
English Synonyms: CP-346086 DIHYDRATE ; 4'-TRIFLUOROMETHYL-BIPHENYL-2-CARBOXYLIC ACID [2-(2H-[1,2,4]TRIAZOL-3-YLMETHYL)-1,2,3,4-TETRAHYDRO-ISOQUINOLIN-6-YL]AMIDE DIHYDRATE
MDL Number.: MFCD17215966
H bond acceptor: 6
H bond donor: 2
Smile: c1ccc(c(c1)c2ccc(cc2)C(F)(F)F)C(=O)Nc3ccc4c(c3)CCN(C4)Cc5[nH]ncn5.O.O
InChi: InChI=1S/C26H22F3N5O.2H2O/c27-26(28,29)20-8-5-17(6-9-20)22-3-1-2-4-23(22)25(35)32-21-10-7-19-14-34(12-11-18(19)13-21)15-24-30-16-31-33-24;;/h1-10,13,16H,11-12,14-15H2,(H,32,35)(H,30,31,33);2*1H2
InChiKey: InChIKey=QCUKFGSPPGIYIX-UHFFFAOYSA-N

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