Cas no 132411-99-5 (1-[2-(diethylamino)ethyl]-3-phenyl-2-thioxoimidazolidine-4,5-dione hydrochloride)
132411-99-5 structure
Product Name:1-[2-(diethylamino)ethyl]-3-phenyl-2-thioxoimidazolidine-4,5-dione hydrochloride
CAS No:132411-99-5
MF:C15H20ClN3O2S
MW:341.856201171875
CID:1235379
PubChem ID:3076758
Update Time:2025-04-20
1-[2-(diethylamino)ethyl]-3-phenyl-2-thioxoimidazolidine-4,5-dione hydrochloride Chemical and Physical Properties
Names and Identifiers
-
- 1-[2-(diethylamino)ethyl]-3-phenyl-2-thioxoimidazolidine-4,5-dione hydrochloride
- 1-[2-(diethylamino)ethyl]-3-phenyl-2-sulfanylideneimidazolidine-4,5-dione,hydrochloride
- 132411-99-5
- 3-(beta-N,N-Diethylaminoethylene)-1-phenyl-2-thioxo-4,5-imidazolidinedione hydrochloride
- DTXSID10157539
- 1-(2-(Diethylamino)ethyl)-3-phenyl-2-thioxo-4,5-imidazolidinedione monohydrochloride
- 4,5-Imidazolidinedione, 1-(2-(diethylamino)ethyl)-3-phenyl-2-thioxo-, monohydrochloride
-
- Inchi: 1S/C15H19N3O2S.ClH/c1-3-16(4-2)10-11-17-13(19)14(20)18(15(17)21)12-8-6-5-7-9-12;/h5-9H,3-4,10-11H2,1-2H3;1H
- InChI Key: QSJQUICZOJMTOO-UHFFFAOYSA-N
- SMILES: Cl.S=C1N(C2C=CC=CC=2)C(C(N1CCN(CC)CC)=O)=O
Computed Properties
- Exact Mass: 341.0967
- Monoisotopic Mass: 341.0964758g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 22
- Rotatable Bond Count: 6
- Complexity: 417
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 76?2
Experimental Properties
- PSA: 43.86
1-[2-(diethylamino)ethyl]-3-phenyl-2-thioxoimidazolidine-4,5-dione hydrochloride Related Literature
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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