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1009684-97-2 | 3-(4-methylphenyl)-5-(2-methylpropyl)-2-sulfanylideneimidazolidin-4-one
CAS No: 1009684-97-2 Catalog No: AG019I19 MDL No:MFCD03973121
Product Description
Catalog Number:
AG019I19
Chemical Name:
3-(4-methylphenyl)-5-(2-methylpropyl)-2-sulfanylideneimidazolidin-4-one
CAS Number:
1009684-97-2
Molecular Formula:
C14H18N2OS
Molecular Weight:
262.3705
MDL Number:
MFCD03973121
IUPAC Name:
3-(4-methylphenyl)-5-(2-methylpropyl)-2-sulfanylideneimidazolidin-4-one
InChI:
InChI=1S/C14H18N2OS/c1-9(2)8-12-13(17)16(14(18)15-12)11-6-4-10(3)5-7-11/h4-7,9,12H,8H2,1-3H3,(H,15,18)
InChI Key:
JXAGITHJEIPOLV-UHFFFAOYSA-N
SMILES:
CC(CC1NC(=S)N(C1=O)c1ccc(cc1)C)C
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.114g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
262.371g/mol
Monoisotopic Mass:
262.114g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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