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1443980-15-1 | 1-methyl-2,4-dioxo-2,4-dihydro-1H-3,1-benzoxazine-6-sulfonamide
CAS No: 1443980-15-1 Catalog No: AG01A543 MDL No:MFCD24842789
Product Description
Catalog Number:
AG01A543
Chemical Name:
1-methyl-2,4-dioxo-2,4-dihydro-1H-3,1-benzoxazine-6-sulfonamide
CAS Number:
1443980-15-1
Molecular Formula:
C9H8N2O5S
Molecular Weight:
256.2352
MDL Number:
MFCD24842789
IUPAC Name:
1-methyl-2,4-dioxo-3,1-benzoxazine-6-sulfonamide
InChI:
InChI=1S/C9H8N2O5S/c1-11-7-3-2-5(17(10,14)15)4-6(7)8(12)16-9(11)13/h2-4H,1H3,(H2,10,14,15)
InChI Key:
JUPHYDGWHSRXHK-UHFFFAOYSA-N
SMILES:
O=c1oc(=O)n(c2c1cc(cc2)S(=O)(=O)N)C
Properties
Complexity:
455
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.015g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
256.232g/mol
Monoisotopic Mass:
256.015g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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