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832692-65-6 | 1,8-Naphthyridine, 4-chloro-2-methoxy-7-[3-(trifluoromethyl)-2-pyridinyl]-
CAS No: 832692-65-6 Catalog No: AG004TUW MDL No:
Product Description
Catalog Number:
AG004TUW
Chemical Name:
1,8-Naphthyridine, 4-chloro-2-methoxy-7-[3-(trifluoromethyl)-2-pyridinyl]-
CAS Number:
832692-65-6
Molecular Formula:
C15H9ClF3N3O
Molecular Weight:
339.6997
IUPAC Name:
4-chloro-2-methoxy-7-[3-(trifluoromethyl)pyridin-2-yl]-1,8-naphthyridine
InChI:
InChI=1S/C15H9ClF3N3O/c1-23-12-7-10(16)8-4-5-11(21-14(8)22-12)13-9(15(17,18)19)3-2-6-20-13/h2-7H,1H3
InChI Key:
YUIFAVJWMCXBGO-UHFFFAOYSA-N
SMILES:
COc1cc(Cl)c2c(n1)nc(cc2)c1ncccc1C(F)(F)F
Properties
Complexity:
412
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.039g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
339.702g/mol
Monoisotopic Mass:
339.039g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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