(5Z)-5-(4-hydroxy-6-oxo-3-propan-2-ylcyclohexa-2,4-dien-1-ylidene)-4-(1-methylindol-5-yl)-1,2,4-triazolidin-3-one


Chemical Name: (5Z)-5-(4-hydroxy-6-oxo-3-propan-2-ylcyclohexa-2,4-dien-1-ylidene)-4-(1-methylindol-5-yl)-1,2,4-triazolidin-3-one
CAS Number: 888216-25-9
Product Number: AG00GU3I(AGN-PC-046DHO)
Synonyms:
MDL No: MFCD22420818
Molecular Formula: C20H20N4O3
Molecular Weight: 364.3978

Identification/Properties


Computed Properties
Molecular Weight:
364.405g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
364.154g/mol
Monoisotopic Mass:
364.154g/mol
Topological Polar Surface Area:
90.1A^2
Heavy Atom Count:
27
Formal Charge:
0
Complexity:
610
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

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NMR Spectrum


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