1-benzyl-4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine,(E)-but-2-enedioic acid

Modify Date: 2025-08-24 22:21:58

1-benzyl-4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine,(E)-but-2-enedioic acid Structure
1-benzyl-4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine,(E)-but-2-enedioic acid structure
Common Name 1-benzyl-4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine,(E)-but-2-enedioic acid
CAS Number 19939-36-7 Molecular Weight 537.07000
Density N/A Boiling Point N/A
Molecular Formula C29H29ClN2O4S Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 1-benzyl-4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine,(E)-but-2-enedioic acid
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C29H29ClN2O4S
Molecular Weight 537.07000
Exact Mass 536.15400
PSA 106.38000
LogP 5.49380
Vapour Pressure 5.58E-11mmHg at 25°C
InChIKey QXDGEQGLUAGVBK-WLHGVMLRSA-N
SMILES Clc1ccc2c(c1)C(N1CCN(Cc3ccccc3)CC1)Cc1ccccc1S2.O=C(O)C=CC(=O)O

 Synonyms

8-Chloro-10-(4-benzylpiperazino)-10,11-dihydrodibenzo(b,f)thiepin maleate hemihydrate
1-benzyl-4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine
(E)-but-2-enedioic acid
Piperazine,1-benzyl-4-(8-chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-,maleate,hydrate (2:2:1)
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