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70661-84-6 | 4-Methylpyrido(2,3-e)-1,2,4-thiadiazine 1,1-dioxide
CAS No: 70661-84-6 Catalog No: AG00FUDW MDL No:
Product Description
Catalog Number:
AG00FUDW
Chemical Name:
4-Methylpyrido(2,3-e)-1,2,4-thiadiazine 1,1-dioxide
CAS Number:
70661-84-6
Molecular Formula:
C7H7N3O2S
Molecular Weight:
197.2144
IUPAC Name:
4-methylpyrido[2,3-e][1,2,4]thiadiazine 1,1-dioxide
InChI:
InChI=1S/C7H7N3O2S/c1-10-5-9-13(11,12)6-3-2-4-8-7(6)10/h2-5H,1H3
InChI Key:
DTJGMGURMOPTCG-UHFFFAOYSA-N
SMILES:
CN1C=NS(=O)(=O)c2c1nccc2
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.026g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.212g/mol
Monoisotopic Mass:
197.026g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
71A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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