Clopenthixol dihydrochloride
2-[4-[3-(2-chlorothioxanthen-9-ylidene)propyl]piperazin-1-yl]ethanol;dihydrochloride
| Molecular Formula | C22H27Cl3N2OS |
|---|---|
| Molecular Weight | 473.9 g/mol |
| Topological Polar Surface Area | 52.0 A2 |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 472.09097 |
| Heavy Atoms | 29 |
| Complexity | 509.0 |
Chemical Identifiers
| CAS Number | 633-59-0 |
|---|---|
| SMILES | C1CN(CCN1CCC=C2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)CCO.Cl.Cl |
| InChIKey | LPWNZMIBFHMYMX-UHFFFAOYSA-N |
📖 Product Overview
Clopenthixol dihydrochloride (CAS: 633-59-0) is a chemical compound with molecular formula C22H27Cl3N2OS and molecular weight 473.9 g/mol. Its IUPAC systematic name is 2-[4-[3-(2-chlorothioxanthen-9-ylidene)propyl]piperazin-1-yl]ethanol;dihydrochloride.
LPWNZMIBFHMYMX-UHFFFAOYSA-N.
SMILES: C1CN(CCN1CCC=C2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)CCO.Cl.Cl.
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