Oxymetothepin dimaleate
bis((E)-but-2-enedioic acid);3-[4-(3-methoxy-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]propan-1-ol
Also Known As: Oxymetothepin dimaleate|1-Piperazinepropanol, 4-(10,11-dihydro-8-methoxydibenzo(b,f)thiepin-10-yl)-, (Z)-2-butenedioate (1:2)|(E)-but-2-enedioic acid; 3-[4-(3-methoxy-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]propan-1-ol
CAS: 29599-85-7
| Molecular Formula | C30H36N2O10S |
|---|---|
| Molecular Weight | 616.20905 g/mol |
| LogP | 2.8672 |
| Topological Polar Surface Area | 185.14 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 616.20905 |
| Monoisotopic Mass | 616.20905 |
| Heavy Atoms | 43 |
| Complexity | 1239.5969 |
Chemical Identifiers
| CAS Number | 29599-85-7 |
|---|---|
| SMILES | COC1=CC2=C(SC3=CC=CC=C3CC2N4CCN(CC4)CCCO)C=C1.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O |
Product Overview
Oxymetothepin dimaleate (CAS 29599-85-7), with molecular formula C30H36N2O10S and molecular weight 616.20905 g/mol. IUPAC: bis((E)-but-2-enedioic acid);3-[4-(3-methoxy-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]propan-1-ol.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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