AC1MC1IJ
methyl (E)-4-[amino(1,3-benzothiazol-2-yl)carbamoyl]-5-morpholin-4-yl-3-oxohex-4-enoate
Also Known As: (E)-methyl 4-(1-(benzo[d]thiazol-2-yl)hydrazinecarbonyl)-5-morpholino-3-oxohex-4-enoate|methyl (E)-4-[amino(1,3-benzothiazol-2-yl)carbamoyl]-5-morpholin-4-yl-3-oxohex-4-enoate
CAS: 523990-59-2
| Molecular Formula | C19H22N4O5S |
|---|---|
| Molecular Weight | 418.1311 g/mol |
| LogP | 1.2414 |
| Topological Polar Surface Area | 115.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 418.1311 |
| Monoisotopic Mass | 418.1311 |
| Heavy Atoms | 29 |
| Complexity | 931.4151 |
Chemical Identifiers
| CAS Number | 523990-59-2 |
|---|---|
| SMILES | C/C(=C(/C(=O)CC(=O)OC)\C(=O)N(C1=NC2=CC=CC=C2S1)N)/N3CCOCC3 |
Product Overview
AC1MC1IJ (CAS 523990-59-2), with molecular formula C19H22N4O5S and molecular weight 418.1311 g/mol. IUPAC: methyl (E)-4-[amino(1,3-benzothiazol-2-yl)carbamoyl]-5-morpholin-4-yl-3-oxohex-4-enoate.
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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