4-(3,4-DIHYDRO-2H-1,5-BENZODIOXEPIN-7-YL)-6-(TRIFLUOROMETHYL)-2-PYRIMIDINAMINE

CAS No.
519056-64-5
CCD No.
CCD00329962
Formula
C14 H12 F3 N3 O2
MolWeight
311.262

Basic Information

Product Name: 4-(3,4-DIHYDRO-2H-1,5-BENZODIOXEPIN-7-YL)-6-(TRIFLUOROMETHYL)-2-PYRIMIDINAMINE
CAS: 519056-64-5
English Synonyms: 4-(3,4-DIHYDRO-2H-1,5-BENZODIOXEPIN-7-YL)-6-(TRIFLUOROMETHYL)-2-PYRIMIDINAMINE
MDL Number.: MFCD02678169
H bond acceptor: 5
H bond donor: 1
Smile: c1cc2c(cc1c3cc(nc(n3)N)C(F)(F)F)OCCCO2
InChi: InChI=1S/C14H12F3N3O2/c15-14(16,17)12-7-9(19-13(18)20-12)8-2-3-10-11(6-8)22-5-1-4-21-10/h2-3,6-7H,1,4-5H2,(H2,18,19,20)
InChiKey: InChIKey=NISKCTNAMXUPLM-UHFFFAOYSA-N

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