5-O-(2-cyanoethyl) 3-O-methyl (4S)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate


Chemical Name: 5-O-(2-cyanoethyl) 3-O-methyl (4S)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
CAS Number: 75130-24-4
Product Number: AG0056KS(AGN-PC-03X0BT)
Synonyms:
MDL No:
Molecular Formula: C19H19N3O6
Molecular Weight: 385.3707

Identification/Properties


Properties
MP:
136-139ºC
Storage:
-10 ℃;
Form:
Solid
Computed Properties
Molecular Weight:
385.376g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
7
Exact Mass:
385.127g/mol
Monoisotopic Mass:
385.127g/mol
Topological Polar Surface Area:
134A^2
Heavy Atom Count:
28
Formal Charge:
0
Complexity:
770
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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