2-(4-chlorophenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one

Modify Date: 2025-08-28 20:38:08

2-(4-chlorophenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Structure
2-(4-chlorophenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one structure
Common Name 2-(4-chlorophenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one
CAS Number 77261-93-9 Molecular Weight 289.78000
Density N/A Boiling Point N/A
Molecular Formula C15H12ClNOS Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 2-(4-chlorophenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C15H12ClNOS
Molecular Weight 289.78000
Exact Mass 289.03300
PSA 57.89000
LogP 4.60070
InChIKey MBAGVOSRMBZBQA-UHFFFAOYSA-N
SMILES O=C1CC(c2ccc(Cl)cc2)Sc2ccccc2N1

 Synthetic Route

~27%

2-(4-chlorophenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Structure

2-(4-chlorophen...

CAS#:77261-93-9

Literature: Zhang, Peng; Hu, Hai-Rong; Bian, Shi-Hui; Huang, Zhao-Hui; Chu, Yong; Ye, De-Yong European Journal of Medicinal Chemistry, 2013 , vol. 61, p. 95 - 103

~72%

2-(4-chlorophenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Structure

2-(4-chlorophen...

CAS#:77261-93-9

Literature: Wang, Xiaoxia; Li, Zhifang; Zhu, Xiangming; Mao, Hui; Zou, Xuefei; Kong, Lichun; Li, Xinsheng Tetrahedron, 2008 , vol. 64, # 27 p. 6510 - 6521

~%

2-(4-chlorophenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Structure

2-(4-chlorophen...

CAS#:77261-93-9

Literature: Ambrogi; Giampietri; Grandolini; Perioli; Ricci; Tuttobello Archiv der Pharmazie, 1992 , vol. 325, # 9 p. 569 - 577

~%

2-(4-chlorophenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Structure

2-(4-chlorophen...

CAS#:77261-93-9

Literature: Ambrogi; Giampietri; Grandolini; Perioli; Ricci; Tuttobello Archiv der Pharmazie, 1992 , vol. 325, # 9 p. 569 - 577

~%

2-(4-chlorophenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Structure

2-(4-chlorophen...

CAS#:77261-93-9

Literature: Zhang, Peng; Hu, Hai-Rong; Bian, Shi-Hui; Huang, Zhao-Hui; Chu, Yong; Ye, De-Yong European Journal of Medicinal Chemistry, 2013 , vol. 61, p. 95 - 103

 Synonyms

4T-0660
4-Oxo-2-<4-chlor-phenyl>-2,3,4,5-tetrahydro-1,5-benzothiazepin
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