AC1N97HI
methyl 2-[6-fluoro-2-(3-phenylsulfanylpropanoylimino)-1,3-benzothiazol-3-yl]acetate
Also Known As: F1366-5030|(Z)-methyl 2-(6-fluoro-2-((3-(phenylthio)propanoyl)imino)benzo[d]thiazol-3(2H)-yl)acetate|methyl 2-[(2Z)-6-fluoro-2-{[3-(phenylsulfanyl)propanoyl]imino}-2,3-dihydro-1,3-benzothiazol-3-yl]acetate|methyl 2-[6-fluoro-2-(3-phenylsulfanylpropanoylimino)-1,3-benzothiazol-3-yl]acetate|methyl [(Z)-6-fluoro-2-[3-(phenylthio)propionylimino]-2,3-dihydro-1,3-benzothiazolidin-3-yl]acetate
CAS: 941997-46-2
| Molecular Formula | C19H17FN2O3S2 |
|---|---|
| Molecular Weight | 404.06647 g/mol |
| LogP | 3.6246 |
| Topological Polar Surface Area | 60.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 404.06647 |
| Monoisotopic Mass | 404.06647 |
| Heavy Atoms | 27 |
| Complexity | 1028.3608 |
Chemical Identifiers
| CAS Number | 941997-46-2 |
|---|---|
| SMILES | COC(=O)CN1C2=C(C=C(C=C2)F)SC1=NC(=O)CCSC3=CC=CC=C3 |
Product Overview
AC1N97HI (CAS 941997-46-2), with molecular formula C19H17FN2O3S2 and molecular weight 404.06647 g/mol. IUPAC: methyl 2-[6-fluoro-2-(3-phenylsulfanylpropanoylimino)-1,3-benzothiazol-3-yl]acetate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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