| CAS Number | 1181457-74-8 |
| Catalog Number | AG019VBM |
| Chemical Name | 3-(Piperazine-1-sulfonyl)-1lambda6-thiolane-1,1-dione hydrochloride |
| IUPAC Name | 3-piperazin-1-ylsulfonylthiolane 1,1-dioxide;hydrochloride |
| InChI | InChI=1S/C8H16N2O4S2.ClH/c11-15(12)6-1-8(7-15)16(13,14)10-4-2-9-3-5-10;/h8-9H,1-7H2;1H |
| InChI Key | YWWOUMUORLEOHJ-UHFFFAOYSA-N |
| MDL Number | MFCD12197106 |
| Molecular Formula | C8H17ClN2O4S2 |
| Molecular Weight | 304.8146 |
| SMILES | Cl.O=S(N1CCNCC1)(C1CS(=O)(=O)CC1)=O |
| Synonyms | 1181457-74-8,
3-(piperazine-1-sulfonyl)-1lambda6-thiolane-1,1-dione hydrochloride,
3-(PIPERAZINE-1-SULFONYL)-1$L^{6}-THIOLANE-1,1-DIONE HYDROCHLORIDE,
AC1Q3ETH,
3-(piperazine-1-sulfonyl)-1,
CTK7I2305,
MCULE-1018079736,
NE24928,
EN300-44818,
Z540727616,
3-(piperazine-1-sulfonyl)-1??-thiolane-1,1-dione hydrochloride,
3-(piperazine-1-sulfonyl)-1lambda-thiolane-1,1-dione hydrochloride,
|
| Complexity | 439 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 304.032g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 304.804g/mol |
| Monoisotopic Mass | 304.032g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 100A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number