1-(3-ethoxy-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methylpiperazine;methanesulfonic acid
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![1-(3-ethoxy-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methylpiperazine;methanesulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/5b671355387849efb671fdf90d8ca6d3.png "1-(3-ethoxy-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methylpiperazine;methanesulfonic acid")
1-(3-ethoxy-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methylpiperazine;methanesulfonic acid
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CAS No:
39841-87-7
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Formula:
C23H34N2O7S3
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Chemical Name:
1-(3-ethoxy-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methylpiperazine;methanesulfonic acid
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Synonyms:
39841-87-7;8-Ethoxy-10-(4-methylpiperazino)-10,11-dihydrodibenzo(b,f)thiepin dimethanesulfonate;DTXSID30960406;1-(10,11-Dihydro-8-ethoxydibenzo(b,f)thiepin-10-yl)-4-methylpiperazine dimethanesulfonate;Piperazine, 1-(10,11-dihydro-8-ethoxydibenzo(b,f)thiepin-10-yl)-4-methyl-, dimethanesulfonate;Methanesulfonic acid--1-(8-ethoxy-10,11-dihydrodibenzo[b,f]thiepin-10-yl)-4-methylpiperazine (2/1)
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CAS No:
1-(3-ethoxy-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methylpiperazine;methanesulfonic acid Basic Attributes
546.7 g/mol
546.15281495 g/mol
Computed Properties
Molecular Weight:546.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:3
Exact Mass:546.15281495
Monoisotopic Mass:546.15281495
Topological Polar Surface Area:167
Heavy Atom Count:35
Complexity:519
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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