| CAS Number | 1269151-57-6 |
| Catalog Number | AG01ABIH |
| Chemical Name | 1-([5-(Thiophen-2-yl)-1,2,4-oxadiazol-3-yl]methyl)piperazine dihydrochloride |
| IUPAC Name | 3-(piperazin-1-ylmethyl)-5-thiophen-2-yl-1,2,4-oxadiazole;dihydrochloride |
| InChI | InChI=1S/C11H14N4OS.2ClH/c1-2-9(17-7-1)11-13-10(14-16-11)8-15-5-3-12-4-6-15;;/h1-2,7,12H,3-6,8H2;2*1H |
| InChI Key | XBVFYWGXIRNZQL-UHFFFAOYSA-N |
| MDL Number | MFCD18380605 |
| Molecular Formula | C11H16Cl2N4OS |
| Molecular Weight | 323.2419 |
| SMILES | Cl.Cl.C(C1N=C(C2SC=CC=2)ON=1)N1CCNCC1 |
| Synonyms | 1-{[5-(thiophen-2-yl)-1,2,4-oxadiazol-3-yl]methyl}piperazine dihydrochloride,
1269151-57-6,
AC1Q3A2F,
MCULE-8421221047,
NE23877,
EN300-71713,
Z1266823245,
|
| Complexity | 250 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 322.042g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 323.236g/mol |
| Monoisotopic Mass | 322.042g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 82.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number