Cas no 21697-42-7 (2-amino-4-methyl-N-(2,4,6-trimethylphenyl)-1,3-thiazole-5-carboxamide)
21697-42-7 structure
Product Name:2-amino-4-methyl-N-(2,4,6-trimethylphenyl)-1,3-thiazole-5-carboxamide
CAS No:21697-42-7
MF:C14H17N3OS
MW:275.36928153038
CID:1408978
PubChem ID:210813
Update Time:2025-04-20
2-amino-4-methyl-N-(2,4,6-trimethylphenyl)-1,3-thiazole-5-carboxamide Chemical and Physical Properties
Names and Identifiers
-
- 2-amino-4-methyl-N-(2,4,6-trimethylphenyl)-1,3-thiazole-5-carboxamide
- 5-thiazolecarboxamide, 2-amino-4-methyl-N-(2,4,6-trimethylphenyl)-
- 2-Amino-4-methyl-N-(2,4,6-trimethylphenyl)-5-thiazolecarboxamide
- CHEMBL307976
- 21697-42-7
- BDBM13215
- DTXSID50176082
- 2-Aminothiazole 1
- NJHVQEJXKUFUMU-UHFFFAOYSA-N
- DB-409080
- 2-Amino-N-(2,4,6-trimethylphenyl)-4-methyl-5-thiazolecarboxamide
- SCHEMBL1539909
- AKOS012087503
- 2-Amino-N-(2.4,6-trimethylphenyl)-4-methyl-5-thiazolecarboxamide
-
- Inchi： 1S/C14H17N3OS/c1-7-5-8(2)11(9(3)6-7)17-13(18)12-10(4)16-14(15)19-12/h5-6H,1-4H3,(H2,15,16)(H,17,18)
- InChI Key： NJHVQEJXKUFUMU-UHFFFAOYSA-N
- SMILES： S1C(N)=NC(C)=C1C(NC1C(C)=CC(C)=CC=1C)=O
Computed Properties
- Exact Mass: 275.10941
- Monoisotopic Mass: 275.10923335g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 327
- 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: 3.3
- Topological Polar Surface Area: 96.2?2
Experimental Properties
- PSA: 68.01
2-amino-4-methyl-N-(2,4,6-trimethylphenyl)-1,3-thiazole-5-carboxamide Related Literature
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Jason Wan Lab Chip, 2020,20, 4528-4538
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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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