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


Chemical Name: 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,6-[[(2R)-amino(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-,monosodium salt, (2S,5R,6R)-
CAS Number: 34642-77-8
Product Number: AG00I6U9(AGN-PC-0RA0DS)
Synonyms:
MDL No:
Molecular Formula: C16H18N3NaO5S
Molecular Weight: 387.3860

Identification/Properties


Properties
MP:
>200°C
BP:
743.2°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Liquid
Computed Properties
Molecular Weight:
387.386g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
4
Exact Mass:
387.086g/mol
Monoisotopic Mass:
387.086g/mol
Topological Polar Surface Area:
161A^2
Heavy Atom Count:
26
Formal Charge:
0
Complexity:
596
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
4
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


NMR Spectrum


Other Analytical Data


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