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Home > Fluorides > 303162-82-5
303162-82-5 | Benzenepropanamide, N-[4-[2-ethyl-4-(3-methylphenyl)-5-thiazolyl]-2-pyridinyl]-4-fluoro-
CAS No: 303162-82-5 Catalog No: AG002ZPZ MDL No:
Product Description
Catalog Number:
AG002ZPZ
Chemical Name:
Benzenepropanamide, N-[4-[2-ethyl-4-(3-methylphenyl)-5-thiazolyl]-2-pyridinyl]-4-fluoro-
CAS Number:
303162-82-5
Molecular Formula:
C26H24FN3OS
Molecular Weight:
445.5517
IUPAC Name:
N-[4-[2-ethyl-4-(3-methylphenyl)-1,3-thiazol-5-yl]pyridin-2-yl]-3-(4-fluorophenyl)propanamide
InChI:
InChI=1S/C26H24FN3OS/c1-3-24-30-25(19-6-4-5-17(2)15-19)26(32-24)20-13-14-28-22(16-20)29-23(31)12-9-18-7-10-21(27)11-8-18/h4-8,10-11,13-16H,3,9,12H2,1-2H3,(H,28,29,31)
InChI Key:
MUOZCSALJLQCFC-UHFFFAOYSA-N
SMILES:
CCc1sc(c(n1)c1cccc(c1)C)c1ccnc(c1)NC(=O)CCc1ccc(cc1)F
Properties
Complexity:
600
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
445.162g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
445.556g/mol
Monoisotopic Mass:
445.162g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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