YM-202074 SESQUIFUMARATE SALT HYDRATE

CAS No.
CCD No.
CCD03258992
Formula
3 C22 H30 N4 O2 S . 2 C4 H4 O4 . H2 O
MolWeight
1493.87

Basic Information

Product Name: YM-202074 SESQUIFUMARATE SALT HYDRATE
English Synonyms: YM-202074 SESQUIFUMARATE SALT HYDRATE ; N-CYCLOHEXYL-6-[[(2-METHOXYETHYL)(METHYL)AMINO]METHYL]-N-METHYLTHIAZOLO[3,2-A]BENZIMIDAZOLE-2-CARBOXAMIDE SESQUIFUMARATE SALT HYDRATE
MDL Number.: MFCD16879020
H bond acceptor: 6
H bond donor: 0
Smile: CN(CCOC)Cc1ccc2c(c1)n3cc(sc3n2)C(=O)N(C)C4CCCCC4.CN(CCOC)Cc1ccc2c(c1)n3cc(sc3n2)C(=O)N(C)C4CCCCC4.CN(CCOC)Cc1ccc2c(c1)n3cc(sc3n2)C(=O)N(C)C4CCCCC4.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O.O
InChi: InChI=1S/3C22H30N4O2S.2C4H4O4.H2O/c3*1-24(11-12-28-3)14-16-9-10-18-19(13-16)26-15-20(29-22(26)23-18)21(27)25(2)17-7-5-4-6-8-17;2*5-3(6)1-2-4(7)8;/h3*9-10,13,15,17H,4-8,11-12,14H2,1-3H3;2*1-2H,(H,5,6)(H,7,8);1H2/b;;;2*2-1+;
InChiKey: InChIKey=MCGFIZFYSARKON-RAMYONIISA-N

Property

Safety information

Symbol: GHS06 GHS06
Signal word: Danger
Hazard statements: H301-H319
Precautionary statements: P301 + P310-P305 + P351 + P338
hazard symbol: T
Risk Code: R:25-36
Safe Code: S:26-45
WGK Germany: 3

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