methanesulfonic acid,3-methylsulfonyl-5-piperazin-1-yl-5,6-dihydrobenzo[b][1]benzothiepine 11-oxide

Modify Date: 2025-10-04 11:55:28

methanesulfonic acid,3-methylsulfonyl-5-piperazin-1-yl-5,6-dihydrobenzo[b][1]benzothiepine 11-oxide Structure
methanesulfonic acid,3-methylsulfonyl-5-piperazin-1-yl-5,6-dihydrobenzo[b][1]benzothiepine 11-oxide structure
Common Name methanesulfonic acid,3-methylsulfonyl-5-piperazin-1-yl-5,6-dihydrobenzo[b][1]benzothiepine 11-oxide
CAS Number 74667-81-5 Molecular Weight 582.73100
Density N/A Boiling Point N/A
Molecular Formula C21H30N2O9S4 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name methanesulfonic acid,3-methylsulfonyl-5-piperazin-1-yl-5,6-dihydrobenzo[b][1]benzothiepine 11-oxide
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C21H30N2O9S4
Molecular Weight 582.73100
Exact Mass 582.08300
PSA 219.57000
LogP 5.14200
InChIKey DHBXDPAMTUXDKX-UHFFFAOYSA-N
SMILES CS(=O)(=O)O.CS(=O)(=O)O.CS(=O)(=O)c1ccc2c(c1)C(N1CCNCC1)Cc1ccccc1S2=O

 Synonyms

3-methylsulfonyl-5-piperazin-1-yl-5,6-dihydrobenzo[b][1]benzothiepine 11-oxide
Piperazine,1-(10,11-dihydro-8-(methylsulfonyl)dibenzo(b,f)thiepin-10-yl)-,S-oxide,methanesulfonate,hydrate (2:4:1)
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