methyl 3-{[(3-chloroanilino)carbonyl]amino}-3-(3-fluorophenyl)propanoate


Chemical Name: methyl 3-{[(3-chloroanilino)carbonyl]amino}-3-(3-fluorophenyl)propanoate
CAS Number: 439121-10-5
Product Number: AG00IRHT(AGN-PC-0WAXLI)
Synonyms:
MDL No: MFCD03012747
Molecular Formula: C17H16ClFN2O3
Molecular Weight: 350.7719

Identification/Properties


Computed Properties
Molecular Weight:
350.774g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
6
Exact Mass:
350.083g/mol
Monoisotopic Mass:
350.083g/mol
Topological Polar Surface Area:
67.4A^2
Heavy Atom Count:
24
Formal Charge:
0
Complexity:
438
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

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NMR Spectrum


Other Analytical Data


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