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Home > Fluorides > 1303588-25-1
1303588-25-1 | Pyrido[2,3-b]pyrazin-2(1H)-one, 3,4-dihydro-1-methyl-6-[3-(trifluoromethyl)phenyl]-
CAS No: 1303588-25-1 Catalog No: AG000UAP MDL No:
Product Description
Catalog Number:
AG000UAP
Chemical Name:
Pyrido[2,3-b]pyrazin-2(1H)-one, 3,4-dihydro-1-methyl-6-[3-(trifluoromethyl)phenyl]-
CAS Number:
1303588-25-1
Molecular Formula:
C15H12F3N3O
Molecular Weight:
307.2705
IUPAC Name:
1-methyl-6-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrido[2,3-b]pyrazin-2-one
InChI:
InChI=1S/C15H12F3N3O/c1-21-12-6-5-11(20-14(12)19-8-13(21)22)9-3-2-4-10(7-9)15(16,17)18/h2-7H,8H2,1H3,(H,19,20)
InChI Key:
GUOHMSIKXMBLMG-UHFFFAOYSA-N
SMILES:
O=C1CNc2c(N1C)ccc(n2)c1cccc(c1)C(F)(F)F
Properties
Complexity:
429
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.093g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
307.276g/mol
Monoisotopic Mass:
307.093g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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