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174139-69-6 | 4H-Thieno[3,2-e]-1,2-thiazin-4-one, 6-chloro-2,3-dihydro-, 1,1-dioxide
CAS No: 174139-69-6 Catalog No: AG001ZGZ MDL No:MFCD08695576
Product Description
Catalog Number:
AG001ZGZ
Chemical Name:
4H-Thieno[3,2-e]-1,2-thiazin-4-one, 6-chloro-2,3-dihydro-, 1,1-dioxide
CAS Number:
174139-69-6
Molecular Formula:
C6H4ClNO3S2
Molecular Weight:
237.6839
MDL Number:
MFCD08695576
IUPAC Name:
6-chloro-1,1-dioxo-2,3-dihydrothieno[3,2-e]thiazin-4-one
InChI:
InChI=1S/C6H4ClNO3S2/c7-5-1-3-4(9)2-8-13(10,11)6(3)12-5/h1,8H,2H2
InChI Key:
LZNHLQJIPKRFIH-UHFFFAOYSA-N
SMILES:
Clc1cc2c(s1)S(=O)(=O)NCC2=O
EC Number:
605-711-5
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.932g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
237.672g/mol
Monoisotopic Mass:
236.932g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
99.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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