Cas no 1420889-17-3 ((3-Methylthiophen-2-yl)-piperazin-1-ylmethanone)
1420889-17-3 structure
Product Name:(3-Methylthiophen-2-yl)-piperazin-1-ylmethanone
CAS No:1420889-17-3
MF:C10H14N2OS
MW:210.295960903168
CID:2172135
Update Time:2023-08-05
(3-Methylthiophen-2-yl)-piperazin-1-ylmethanone Chemical and Physical Properties
Names and Identifiers
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- (3-Methylthiophen-2-yl)(piperazin-1-yl)methanone hydrochloride
- (3-Methylthiophen-2-yl)-piperazin-1-ylmethanone
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- Inchi： 1S/C10H14N2OS/c1-8-2-7-14-9(8)10(13)12-5-3-11-4-6-12/h2,7,11H,3-6H2,1H3
- InChI Key： NMCHCXUMUMNEMZ-UHFFFAOYSA-N
- SMILES： S1C=CC(C)=C1C(N1CCNCC1)=O
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 216
- Topological Polar Surface Area: 60.6
(3-Methylthiophen-2-yl)-piperazin-1-ylmethanone Related Literature
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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