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70661-86-8

70661-86-8 | 2H-Pyrido[2,3-e]-1,2,4-thiadiazine,3-methyl-,1,1-dioxide(9CI)

CAS No: 70661-86-8 Catalog No: AG00FS6O MDL No:MFCD01690018

Product Description

Catalog Number:
AG00FS6O
Chemical Name:
2H-Pyrido[2,3-e]-1,2,4-thiadiazine,3-methyl-,1,1-dioxide(9CI)
CAS Number:
70661-86-8
Molecular Formula:
C7H7N3O2S
Molecular Weight:
197.2144
MDL Number:
MFCD01690018
IUPAC Name:
3-methyl-4H-pyrido[2,3-e][1,2,4]thiadiazine 1,1-dioxide
InChI:
InChI=1S/C7H7N3O2S/c1-5-9-7-6(3-2-4-8-7)13(11,12)10-5/h2-4H,1H3,(H,8,9,10)
InChI Key:
BTHSSYLQNVNWJG-UHFFFAOYSA-N
SMILES:
CC1=NS(=O)(=O)c2c(N1)nccc2

Properties

Complexity:
330  
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:
1  
Isotope Atom Count:
0
Molecular Weight:
197.212g/mol
Monoisotopic Mass:
197.026g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
79.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  

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