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Home > Imidazoles > 917750-45-9
917750-45-9 | 1-(2-Furylmethyl)-5-(4-methoxyphenyl)-1,3-dihydro-2H-imidazole-2-thione
CAS No: 917750-45-9 Catalog No: AG01AR74 MDL No:MFCD08898628
Product Description
Catalog Number:
AG01AR74
Chemical Name:
1-(2-Furylmethyl)-5-(4-methoxyphenyl)-1,3-dihydro-2H-imidazole-2-thione
CAS Number:
917750-45-9
Molecular Formula:
C15H14N2O2S
Molecular Weight:
286.3489
MDL Number:
MFCD08898628
IUPAC Name:
3-(furan-2-ylmethyl)-4-(4-methoxyphenyl)-1H-imidazole-2-thione
InChI:
InChI=1S/C15H14N2O2S/c1-18-12-6-4-11(5-7-12)14-9-16-15(20)17(14)10-13-3-2-8-19-13/h2-9H,10H2,1H3,(H,16,20)
InChI Key:
WDKNAJVLINXSHX-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1cnc(n1Cc1ccco1)S
Properties
Complexity:
391
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.078g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
286.349g/mol
Monoisotopic Mass:
286.078g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
69.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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