4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3,3-dimethyl-6-[[(5-methyl-3-phenyl-4-isoxazolyl)carbonyl]amino]-7-oxo-,monosodium salt, (2S,5R,6R)-


Chemical Name: 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3,3-dimethyl-6-[[(5-methyl-3-phenyl-4-isoxazolyl)carbonyl]amino]-7-oxo-,monosodium salt, (2S,5R,6R)-
CAS Number: 1173-88-2
Product Number: AG0077SO(AGN-PC-0PAG7Z)
Synonyms:
MDL No:
Molecular Formula: C19H18N3NaO5S
Molecular Weight: 423.4181

Identification/Properties


Computed Properties
Molecular Weight:
423.419g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
4
Exact Mass:
423.086g/mol
Monoisotopic Mass:
423.086g/mol
Topological Polar Surface Area:
141A^2
Heavy Atom Count:
29
Formal Charge:
0
Complexity:
687
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
3
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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