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80348-59-0 | 1H-Imidazole-5-sulfonamide, 1-methyl-N-(4-morpholinylmethyl)-4-nitro-
CAS No: 80348-59-0 Catalog No: AG00GDD0 MDL No:
Product Description
Catalog Number:
AG00GDD0
Chemical Name:
1H-Imidazole-5-sulfonamide, 1-methyl-N-(4-morpholinylmethyl)-4-nitro-
CAS Number:
80348-59-0
IUPAC Name:
3-methyl-N-(morpholin-4-ylmethyl)-5-nitroimidazole-4-sulfonamide
InChI:
InChI=1S/C9H15N5O5S/c1-12-6-10-8(14(15)16)9(12)20(17,18)11-7-13-2-4-19-5-3-13/h6,11H,2-5,7H2,1H3
InChI Key:
XNLGIQHELXECGM-UHFFFAOYSA-N
NSC Number:
46506
Properties
Complexity:
441
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.079g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
305.309g/mol
Monoisotopic Mass:
305.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
131A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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