| CAS Number | 1823822-55-4 |
| Catalog Number | AG019EXQ(AGN-PC-0WG4UJ) |
| Chemical Name | Benzyl 3-(2-Aminothiazol-4-Yl)Morpholine-4-Carboxylate |
| IUPAC Name | benzyl 3-(2-amino-1,3-thiazol-4-yl)morpholine-4-carboxylate |
| InChI | InChI=1S/C15H17N3O3S/c16-14-17-12(10-22-14)13-9-20-7-6-18(13)15(19)21-8-11-4-2-1-3-5-11/h1-5,10,13H,6-9H2,(H2,16,17) |
| InChI Key | RHWNUNCWITXKGU-UHFFFAOYSA-N |
| MDL Number | MFCD27997377 |
| Molecular Formula | C15H17N3O3S |
| Molecular Weight | 319.3788 |
| SMILES | N=c1[nH]c(cs1)C1COCCN1C(=O)OCc1ccccc1 |
| Synonyms | Benzyl 3-(2-aminothiazol-4-yl)morpholine-4-carboxylate,
1823822-55-4,
MFCD27997377,
Benzyl 3-(2-Aminothiazol-4-Yl)Morpholine-4-Carboxylate(WX160189),
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| Complexity | 379 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 319.099g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 319.379g/mol |
| Monoisotopic Mass | 319.099g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 106A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
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Certificate of Analysis
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