Cas no 3161-69-1 (5-Thiazolecarboxylic acid, 2-(acetylmethylamino)-4-methyl-, ethyl ester)
3161-69-1 structure
Product Name:5-Thiazolecarboxylic acid, 2-(acetylmethylamino)-4-methyl-, ethyl ester
CAS No:3161-69-1
MF:C10H14N2O3S
MW:242.294761180878
CID:1448051
PubChem ID:886209
Update Time:2025-04-20
5-Thiazolecarboxylic acid, 2-(acetylmethylamino)-4-methyl-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 5-Thiazolecarboxylic acid, 2-(acetylmethylamino)-4-methyl-, ethyl ester
- 2-N-acetylamino-N-methyl-4-methylthiazole-5-carboxylic acid ethyl ester
- HMS1694A18
- Ethyl 2-(acetylmethylamino)-4-methyl-5-thiazolecarboxylate
- ethyl 2-[ethanoyl(methyl)amino]-4-methyl-1,3-thiazole-5-carboxylate
- Z1230032143
- 3161-69-1
- MLS000529346
- 2-(Acetyl-methyl-amino)-4-methyl-thiazole-5-carboxylic acid ethyl ester
- CHEMBL1727150
- cid_886209
- AKOS000549358
- 2-[acetyl(methyl)amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester
- ethyl 2-[acetyl(methyl)amino]-4-methyl-1,3-thiazole-5-carboxylate
- DTXSID801194856
- BDBM45453
- HMS2349B12
- Ethyl 4-methyl-2-(N-methylacetamido)thiazole-5-carboxylate
- 2-[acetyl(methyl)amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester
- SMR000121821
- STK841243
-
- Inchi： 1S/C10H14N2O3S/c1-5-15-9(14)8-6(2)11-10(16-8)12(4)7(3)13/h5H2,1-4H3
- InChI Key： QUYPYEYQAFHKSV-UHFFFAOYSA-N
- SMILES： S1C(C(=O)OCC)=C(C)N=C1N(C(C)=O)C
Computed Properties
- Exact Mass: 242.07262
- Monoisotopic Mass: 242.07251349g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 285
- 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: 1.6
- Topological Polar Surface Area: 87.7?2
Experimental Properties
- PSA: 68.29
5-Thiazolecarboxylic acid, 2-(acetylmethylamino)-4-methyl-, ethyl ester Related Literature
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
-
Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
-
Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
-
J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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