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Home > Fluorides > 897304-05-1
897304-05-1 | 5-FLUORO-1,3-BIS[(4-METHOXYPHENYL)METHYL]-2,4(1H,3H)-PYRIMIDINEDIONE
CAS No: 897304-05-1 Catalog No: AG0041I3 MDL No:
Product Description
Catalog Number:
AG0041I3
Chemical Name:
5-FLUORO-1,3-BIS[(4-METHOXYPHENYL)METHYL]-2,4(1H,3H)-PYRIMIDINEDIONE
CAS Number:
897304-05-1
Molecular Formula:
C20H19FN2O4
Molecular Weight:
370.3743
IUPAC Name:
5-fluoro-1,3-bis[(4-methoxyphenyl)methyl]pyrimidine-2,4-dione
InChI:
InChI=1S/C20H19FN2O4/c1-26-16-7-3-14(4-8-16)11-22-13-18(21)19(24)23(20(22)25)12-15-5-9-17(27-2)10-6-15/h3-10,13H,11-12H2,1-2H3
InChI Key:
GXYGWQHJJWACMQ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)Cn1cc(F)c(=O)n(c1=O)Cc1ccc(cc1)OC
Properties
Complexity:
566
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
370.133g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
370.38g/mol
Monoisotopic Mass:
370.133g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
59.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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