Cas no 606117-68-4 (4-Thiazolecarboxamide,2-(acetylamino)-N-(4,5,6,7-tetrahydro-5,5-dimethyl-7-oxo-2-benzothiazolyl)-(9CI))
606117-68-4 structure
Product Name:4-Thiazolecarboxamide,2-(acetylamino)-N-(4,5,6,7-tetrahydro-5,5-dimethyl-7-oxo-2-benzothiazolyl)-(9CI)
CAS No:606117-68-4
MF:C15H16N4O3S2
MW:364.442540168762
CID:952900
PubChem ID:3224919
Update Time:2025-04-19
4-Thiazolecarboxamide,2-(acetylamino)-N-(4,5,6,7-tetrahydro-5,5-dimethyl-7-oxo-2-benzothiazolyl)-(9CI) Chemical and Physical Properties
Names and Identifiers
-
- 4-Thiazolecarboxamide,2-(acetylamino)-N-(4,5,6,7-tetrahydro-5,5-dimethyl-7-oxo-2-benzothiazolyl)-(9CI)
- 2-Acetamido-N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothi azol-2-yl)-1,3-thiazole-4-carboxamide
- 606117-68-4
- SR-01000344434
- DB-284019
- SR-01000344434-1
- 4-THIAZOLECARBOXAMIDE, 2-(ACETYLAMINO)-N-(4,5,6,7-TETRAHYDRO-5,5-DIMETHYL-7-OXO-2-BENZOTHIAZOLYL)-
- 4-thiazolecarboxamide,2-(acetylamino)-n-(4,5,6,7-tetrahydro-5,5-dimethyl-7-oxo-2-benzothiazolyl)-
- AKOS008752957
-
- Inchi： 1S/C15H16N4O3S2/c1-7(20)16-13-18-9(6-23-13)12(22)19-14-17-8-4-15(2,3)5-10(21)11(8)24-14/h6H,4-5H2,1-3H3,(H,16,18,20)(H,17,19,22)
- InChI Key： ROSXBOPQUFGFSQ-UHFFFAOYSA-N
- SMILES： S1C(NC(C2=CSC(NC(C)=O)=N2)=O)=NC2=C1C(CC(C)(C)C2)=O
Computed Properties
- Exact Mass: 364.066
- Monoisotopic Mass: 364.066
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 24
- Rotatable Bond Count: 3
- Complexity: 557
- 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: 2.3
- Topological Polar Surface Area: 158?2
4-Thiazolecarboxamide,2-(acetylamino)-N-(4,5,6,7-tetrahydro-5,5-dimethyl-7-oxo-2-benzothiazolyl)-(9CI) Related Literature
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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