1-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-4-(2-phenylsulfanylethyl)piperazine,dihydrochloride
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![1-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-4-(2-phenylsulfanylethyl)piperazine,dihydrochloride structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/6d7f376a2c0c4922900490d5ca2844d8.png "1-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-4-(2-phenylsulfanylethyl)piperazine,dihydrochloride")
1-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-4-(2-phenylsulfanylethyl)piperazine,dihydrochloride
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CAS No:
101041-02-5
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Formula:
C26H29Cl3N2S2
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Chemical Name:
1-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-4-(2-phenylsulfanylethyl)piperazine,dihydrochloride
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Synonyms:
1-(2-Chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-4-(2-phenylthio)ethyl piperazine 2HCl; 1-(2-Chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-4-(2-(phenylthio)ethyl)piperazine; 1-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-4-(2-phenylsulfanylethyl)piperazine dihydrochloride; Piperazine,1-(2-chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-4-(2-(phenylthio)ethyl)-,dihydrochloride;
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CAS No:
1-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-4-(2-phenylsulfanylethyl)piperazine,dihydrochloride Basic Attributes
540.01100
538.083774
Computed Properties
Molecular Weight:540.0
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:538.083774
Monoisotopic Mass:538.083774
Topological Polar Surface Area:57.1
Heavy Atom Count:33
Complexity:550
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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