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89446-79-7

89446-79-7 | 2-Imidazolidinone, 1-[2-(butylthio)ethyl]-4-phenyl-

CAS No: 89446-79-7 Catalog No: AG0042WI MDL No:

Product Description

Catalog Number:
AG0042WI
Chemical Name:
2-Imidazolidinone, 1-[2-(butylthio)ethyl]-4-phenyl-
CAS Number:
89446-79-7
Molecular Formula:
C15H22N2OS
Molecular Weight:
278.4130
IUPAC Name:
1-(2-butylsulfanylethyl)-4-phenylimidazolidin-2-one
InChI:
InChI=1S/C15H22N2OS/c1-2-3-10-19-11-9-17-12-14(16-15(17)18)13-7-5-4-6-8-13/h4-8,14H,2-3,9-12H2,1H3,(H,16,18)
InChI Key:
TWEMFPLPEZGQPR-UHFFFAOYSA-N
SMILES:
CCCCSCCN1CC(NC1=O)c1ccccc1

Properties

Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.145g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
278.414g/mol
Monoisotopic Mass:
278.145g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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