H-89 DIHYDROCHLORIDE HYDRATE

CAS No.
130964-39-5
CCD No.
CCD01001462
Formula
C20 H20 Br N3 O2 S . 2 Cl H . H2 O
MolWeight
537.304

Basic Information

Product Name: H-89 DIHYDROCHLORIDE HYDRATE
CAS: 130964-39-5
English Synonyms: 5-ISOQUINOLINESULFONAMIDE, N-[2-[[3-(4-BROMOPHENYL)-2-PROPENYL]AMINO]ETHYL]-, DIHYDROCHLORIDE ; N-[2-(P-BROMOCINNAMYLAMINO)ETHYL]-5-ISOQUINOLINESULFONAMIDE DIHYDROCHLORIDE HYDRATE ; H-89 DIHYDROCHLORIDE HYDRATE ; 5-ISOQUINOLINESULFONAMIDE,N-[2-[[3-(4-BROMOPHENYL)-2-PROPEN-1-YL]AMINO]ETHYL]-, HYDROCHLORIDE (1:2)
MDL Number.: MFCD11045926
H bond acceptor: 5
H bond donor: 2
Smile: c1cc2cnccc2c(c1)S(=O)(=O)NCCNC/C=C/c3ccc(cc3)Br.O.Cl.Cl
InChi: InChI=1S/C20H20BrN3O2S.2ClH.H2O/c21-18-8-6-16(7-9-18)3-2-11-22-13-14-24-27(25,26)20-5-1-4-17-15-23-12-10-19(17)20;;;/h1-10,12,15,22,24H,11,13-14H2;2*1H;1H2/b3-2+;;;
InChiKey: InChIKey=GKFFJFGBWAGAFD-HZBIHQSRSA-N

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WGK Germany: 3

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