methyl 2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl)propanoate
methyl 2-(3-oxo-4H-1,4-benzothiazin-2-yl)propanoate
Also Known As: ChemDiv3_013620|Oprea1_379567|methyl 2-(3-oxo-4H-1,4-benzothiazin-2-yl)propanoate|methyl 2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl)propanoate|IDI1_029770|NCGC00050285-02|AI-204/31682043|AI-204/31682044|METHYL 2-(8-OXO-10-THIA-7-AZABICYCLO[4.4.0]DECA-1,3,5-TRIEN-9-YL)PROPANOATE|SR-01000146031-1|BRD-A58255507-001-01-4|methyl 2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)propanoate|2-(3-keto-4H-1,4-benzothiazin-2-yl)propionic acid methyl ester|2-(3-oxo-4H-1,4-benzothiazin-2-yl)propanoic acid methyl ester|2-(3-Oxo-3,4-dihydro-2H-benzo[1,4]thiazin-2-yl)-propionic acid methyl ester
| Molecular Formula | C12H13NO3S |
|---|---|
| Molecular Weight | 251.06161 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 80.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.06161 |
| Monoisotopic Mass | 251.06161 |
| Heavy Atoms | 17 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 17547-89-6 |
|---|---|
| SMILES | CC(C1C(=O)NC2=CC=CC=C2S1)C(=O)OC |
| InChIKey | MUMHZPJCLHFCOF-UHFFFAOYSA-N |
Product Overview
methyl 2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl)propanoate (CAS 17547-89-6), with molecular formula C12H13NO3S and molecular weight 251.06161 g/mol. IUPAC: methyl 2-(3-oxo-4H-1,4-benzothiazin-2-yl)propanoate.
methyl 2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl)propanoate is a custom synthesis product. We offer services from milligram to kilogram scale.
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