Benzamide,N-(2-hydroxyethyl)-3-[6-[[4-(trifluoromethoxy)phenyl]amino]-4-pyrimidinyl]-


Chemical Name: Benzamide,N-(2-hydroxyethyl)-3-[6-[[4-(trifluoromethoxy)phenyl]amino]-4-pyrimidinyl]-
CAS Number: 778277-15-9
Product Number: AG00G3OF(AGN-PC-0UCCYY)
Synonyms:
MDL No:
Molecular Formula: C20H17F3N4O3
Molecular Weight: 418.3692

Identification/Properties


Computed Properties
Molecular Weight:
418.376g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
9
Rotatable Bond Count:
7
Exact Mass:
418.125g/mol
Monoisotopic Mass:
418.125g/mol
Topological Polar Surface Area:
96.4A^2
Heavy Atom Count:
30
Formal Charge:
0
Complexity:
544
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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