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89446-77-5 | 2-Imidazolidinone, 4-phenyl-1-[2-(propylthio)ethyl]-
CAS No: 89446-77-5 Catalog No: AG0088GA MDL No:
Product Description
Catalog Number:
AG0088GA
Chemical Name:
2-Imidazolidinone, 4-phenyl-1-[2-(propylthio)ethyl]-
CAS Number:
89446-77-5
Molecular Formula:
C14H20N2OS
Molecular Weight:
264.3864
IUPAC Name:
4-phenyl-1-(2-propylsulfanylethyl)imidazolidin-2-one
InChI:
InChI=1S/C14H20N2OS/c1-2-9-18-10-8-16-11-13(15-14(16)17)12-6-4-3-5-7-12/h3-7,13H,2,8-11H2,1H3,(H,15,17)
InChI Key:
KBWKOUPGLBRFJQ-UHFFFAOYSA-N
SMILES:
CCCSCCN1CC(NC1=O)c1ccccc1
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.13g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
264.387g/mol
Monoisotopic Mass:
264.13g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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