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Home > Imidazoles > 21083-49-8
21083-49-8 | 1-Methyl-5,5-diphenyl-2-thioxo-imidazolidin-4-one
CAS No: 21083-49-8 Catalog No: AG01EUIG MDL No:
Product Description
Catalog Number:
AG01EUIG
Chemical Name:
1-Methyl-5,5-diphenyl-2-thioxo-imidazolidin-4-one
CAS Number:
21083-49-8
Molecular Formula:
C16H14N2OS
Molecular Weight:
282.3602
IUPAC Name:
1-methyl-5,5-diphenyl-2-sulfanylideneimidazolidin-4-one
InChI:
InChI=1S/C16H14N2OS/c1-18-15(20)17-14(19)16(18,12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11H,1H3,(H,17,19,20)
InChI Key:
WXMHBVIXLIKIFL-UHFFFAOYSA-N
SMILES:
CN1C(=S)NC(=O)C1(c1ccccc1)c1ccccc1
Properties
Complexity:
379
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.083g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
282.361g/mol
Monoisotopic Mass:
282.083g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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