2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-4,5-diethyl-1,2,4-triazol-3-one;hydrochloride


Chemical Name: 2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-4,5-diethyl-1,2,4-triazol-3-one;hydrochloride
CAS Number: 57775-22-1
Product Number: AG00EEYD(AGN-PC-0JL6P3)
Synonyms:
MDL No: MFCD01678245
Molecular Formula: C19H29Cl2N5O
Molecular Weight: 414.37246

Identification/Properties


Properties
MP:
179-181°C
Storage:
-10 ℃;Inert atmosphere;
Form:
Solid
Computed Properties
Molecular Weight:
414.375g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
7
Exact Mass:
413.175g/mol
Monoisotopic Mass:
413.175g/mol
Topological Polar Surface Area:
42.4A^2
Heavy Atom Count:
27
Formal Charge:
0
Complexity:
506
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:
2
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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