| CAS Number | 1803600-87-4 |
| Catalog Number | AG01B7KM |
| Chemical Name | 2-(methylamino)-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]acetamide dihydrochloride |
| IUPAC Name | 2-(methylamino)-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]acetamide;dihydrochloride |
| InChI | InChI=1S/C9H16N4OS.2ClH/c1-6(2)4-8-12-13-9(15-8)11-7(14)5-10-3;;/h6,10H,4-5H2,1-3H3,(H,11,13,14);2*1H |
| InChI Key | ZZGVKSHKKVFOIR-UHFFFAOYSA-N |
| MDL Number | MFCD28145480 |
| Molecular Formula | C9H18Cl2N4OS |
| Molecular Weight | 301.2364 |
| SMILES | Cl.Cl.CNCC(NC1SC(CC(C)C)=NN=1)=O |
| Synonyms | 2-(methylamino)-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]acetamide dihydrochloride,
1803600-87-4,
|
| Complexity | 212 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 300.058g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 301.23g/mol |
| Monoisotopic Mass | 300.058g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 95.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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