3-[2,4-dimethyl-5-[(2-oxo-6-phenyl-1H-indol-3-ylidene)methyl]-1H-pyrrol-3-yl]propanoic acid


Chemical Name: 3-[2,4-dimethyl-5-[(2-oxo-6-phenyl-1H-indol-3-ylidene)methyl]-1H-pyrrol-3-yl]propanoic acid
CAS Number: 251356-45-3
Product Number: AG00C4IJ(AGN-PC-09SHAB)
Synonyms:
MDL No: MFCD03452699
Molecular Formula: C24H22N2O3
Molecular Weight: 386.4431

Identification/Properties


Computed Properties
Molecular Weight:
386.451g/mol
XLogP3:
3.9
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
5
Exact Mass:
386.163g/mol
Monoisotopic Mass:
386.163g/mol
Topological Polar Surface Area:
82.2A^2
Heavy Atom Count:
29
Formal Charge:
0
Complexity:
655
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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