Cas no 827588-52-3 (4-Thiazolecarboxamide, 2-amino-N-[2-(dimethylamino)ethyl]-)
![4-Thiazolecarboxamide, 2-amino-N-[2-(dimethylamino)ethyl]- structure](https://ossimg.kuujia.com/scimg/828000/827588-52-3x500.png)
827588-52-3 structure
Product Name:4-Thiazolecarboxamide, 2-amino-N-[2-(dimethylamino)ethyl]-
CAS No:827588-52-3
MF:C8H14N4OS
MW:214.287959575653
CID:683607
PubChem ID:58772621
Update Time:2025-04-19
4-Thiazolecarboxamide, 2-amino-N-[2-(dimethylamino)ethyl]- Chemical and Physical Properties
Names and Identifiers
-
- 4-Thiazolecarboxamide, 2-amino-N-[2-(dimethylamino)ethyl]-
- 2-amino-N-[2-(dimethylamino)ethyl]-1,3-thiazole-4-carboxamide
- SCHEMBL2996975
- 827588-52-3
- DTXSID60729922
- AKOS012087777
-
- Inchi： 1S/C8H14N4OS/c1-12(2)4-3-10-7(13)6-5-14-8(9)11-6/h5H,3-4H2,1-2H3,(H2,9,11)(H,10,13)
- InChI Key： QRKOQLDFVQSHON-UHFFFAOYSA-N
- SMILES： S1C(N)=NC(=C1)C(NCCN(C)C)=O
Computed Properties
- Exact Mass: 214.08883226g/mol
- Monoisotopic Mass: 214.08883226g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 200
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.3
- Topological Polar Surface Area: 99.5?2
4-Thiazolecarboxamide, 2-amino-N-[2-(dimethylamino)ethyl]- Related Literature
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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