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470690-99-4 | 2H-Imidazole-2-thione,1,3-dihydro-5-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]-
CAS No: 470690-99-4 Catalog No: AG01AR2E MDL No:MFCD06761604
Product Description
Catalog Number:
AG01AR2E
Chemical Name:
2H-Imidazole-2-thione,1,3-dihydro-5-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]-
CAS Number:
470690-99-4
MDL Number:
MFCD06761604
IUPAC Name:
4-(hydroxymethyl)-3-[(4-methoxyphenyl)methyl]-1H-imidazole-2-thione
InChI:
InChI=1S/C12H14N2O2S/c1-16-11-4-2-9(3-5-11)7-14-10(8-15)6-13-12(14)17/h2-6,15H,7-8H2,1H3,(H,13,17)
InChI Key:
FHQPRJYYYMOYPE-UHFFFAOYSA-N
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.078g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
250.316g/mol
Monoisotopic Mass:
250.078g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
76.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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