6-(6-aminopurin-9-yl)-2-hydroxy-2-sulfanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol;N,N-diethylethanamine


Chemical Name: 6-(6-aminopurin-9-yl)-2-hydroxy-2-sulfanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol;N,N-diethylethanamine
CAS Number: 151837-09-1
Product Number: AG00AQ2S(AGN-PC-00SHN2)
Synonyms:
MDL No:
Molecular Formula: C16H27N6O5PS
Molecular Weight: 446.4615

Identification/Properties


Computed Properties
Molecular Weight:
446.463g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
11
Rotatable Bond Count:
4
Exact Mass:
446.15g/mol
Monoisotopic Mass:
446.15g/mol
Topological Polar Surface Area:
173A^2
Heavy Atom Count:
29
Formal Charge:
0
Complexity:
528
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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