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925412-63-1 | 8-METHYL-2H-[1,4]THIAZINO[3,2-G]QUINOXALINE-3,7(4H,6H)-DIONE
CAS No: 925412-63-1 Catalog No: AG006H3Q MDL No:
Product Description
Catalog Number:
AG006H3Q
Chemical Name:
8-METHYL-2H-[1,4]THIAZINO[3,2-G]QUINOXALINE-3,7(4H,6H)-DIONE
CAS Number:
925412-63-1
Molecular Formula:
C11H9N3O2S
Molecular Weight:
247.2731
IUPAC Name:
8-methyl-4,6-dihydropyrazino[2,3-g][1,4]benzothiazine-3,7-dione
InChI:
InChI=1S/C11H9N3O2S/c1-5-11(16)14-6-2-8-9(3-7(6)12-5)17-4-10(15)13-8/h2-3H,4H2,1H3,(H,13,15)(H,14,16)
InChI Key:
YUJRGXWTSKZDII-UHFFFAOYSA-N
SMILES:
O=C1CSc2c(N1)cc1c(c2)nc(c(=O)[nH]1)C
Properties
Complexity:
410
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.042g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
247.272g/mol
Monoisotopic Mass:
247.042g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
95.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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