Cas no 129865-58-3 (Methanone, [2-(dimethylamino)-5-thiazolyl]phenyl-)
129865-58-3 structure
Product Name:Methanone, [2-(dimethylamino)-5-thiazolyl]phenyl-
CAS No:129865-58-3
MF:C12H12N2OS
MW:232.301481246948
CID:1225021
PubChem ID:14570028
Update Time:2025-04-20
Methanone, [2-(dimethylamino)-5-thiazolyl]phenyl- Chemical and Physical Properties
Names and Identifiers
-
- Methanone, [2-(dimethylamino)-5-thiazolyl]phenyl-
- [2-(dimethylamino)-5-thiazolyl]phenylMethanone
- DA-31794
- AKOS024389085
- 129865-58-3
-
- Inchi: 1S/C12H12N2OS/c1-14(2)12-13-8-10(16-12)11(15)9-6-4-3-5-7-9/h3-8H,1-2H3
- InChI Key: IHRPRYDDVXPRAX-UHFFFAOYSA-N
- SMILES: S1C(=CN=C1N(C)C)C(C1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 232.06716
- Monoisotopic Mass: 232.06703418g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 251
- 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: 3.1
- Topological Polar Surface Area: 61.4?2
Experimental Properties
- PSA: 33.2
Methanone, [2-(dimethylamino)-5-thiazolyl]phenyl- Related Literature
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Mengke Li,Xinyi Cai,Zhenyang Qiao,Wentao Xie,Liangying Wang,Nan Zheng,Shi-Jian Su Chem. Commun., 2019,55, 7215-7218
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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