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881399-30-0

881399-30-0 | 2H-1,2-Benzothiazine-3-carboxamide,N-ethyl-4-hydroxy-2-methyl-N-(5-methyl-2-thiazolyl)-, 1,1-dioxide

CAS No: 881399-30-0 Catalog No: AG008C2U MDL No:

Product Description

Catalog Number:
AG008C2U
Chemical Name:
2H-1,2-Benzothiazine-3-carboxamide,N-ethyl-4-hydroxy-2-methyl-N-(5-methyl-2-thiazolyl)-, 1,1-dioxide
CAS Number:
881399-30-0
Molecular Formula:
C16H17N3O4S2
Molecular Weight:
379.4539
IUPAC Name:
N-ethyl-4-hydroxy-2-methyl-N-(5-methyl-1,3-thiazol-2-yl)-1,1-dioxo-1λ6,2-benzothiazine-3-carboxamide
InChI:
InChI=1S/C16H17N3O4S2/c1-4-19(16-17-9-10(2)24-16)15(21)13-14(20)11-7-5-6-8-12(11)25(22,23)18(13)3/h5-9,20H,4H2,1-3H3
InChI Key:
HGTQFLHZAJMDBY-UHFFFAOYSA-N
SMILES:
CCN(C(=O)C1=C(O)c2ccccc2S(=O)(=O)N1C)c1ncc(s1)C

Properties

Complexity:
673  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
379.066g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
379.449g/mol
Monoisotopic Mass:
379.066g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
127A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  

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