methyl 4-(2-{2-[(4-methoxyanilino)carbothioyl]hydrazino}-2-oxoethoxy)benzenecarboxylate


Chemical Name: methyl 4-(2-{2-[(4-methoxyanilino)carbothioyl]hydrazino}-2-oxoethoxy)benzenecarboxylate
CAS Number: 1022591-11-2
Product Number: AG00J03V(AGN-PC-0WB1YQ)
Synonyms:
MDL No: MFCD00955361
Molecular Formula: C18H19N3O5S
Molecular Weight: 389.4256

Identification/Properties


Computed Properties
Molecular Weight:
389.426g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
7
Exact Mass:
389.105g/mol
Monoisotopic Mass:
389.105g/mol
Topological Polar Surface Area:
130A^2
Heavy Atom Count:
27
Formal Charge:
0
Complexity:
503
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
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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