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1170776-28-9 | 5-ethyl-3-[2-oxo-2-(piperazin-1-yl)ethyl]-5-phenylimidazolidine-2,4-dione
CAS No: 1170776-28-9 Catalog No: AG019LM2 MDL No:MFCD27920380
Product Description
Catalog Number:
AG019LM2
Chemical Name:
5-ethyl-3-[2-oxo-2-(piperazin-1-yl)ethyl]-5-phenylimidazolidine-2,4-dione
CAS Number:
1170776-28-9
Molecular Formula:
C17H22N4O3
Molecular Weight:
330.3816
MDL Number:
MFCD27920380
IUPAC Name:
5-ethyl-3-(2-oxo-2-piperazin-1-ylethyl)-5-phenylimidazolidine-2,4-dione
InChI:
InChI=1S/C17H22N4O3/c1-2-17(13-6-4-3-5-7-13)15(23)21(16(24)19-17)12-14(22)20-10-8-18-9-11-20/h3-7,18H,2,8-12H2,1H3,(H,19,24)
InChI Key:
KNKSKCVVAJDIMO-UHFFFAOYSA-N
SMILES:
CCC1(NC(=O)N(C1=O)CC(=O)N1CCNCC1)c1ccccc1
Properties
Complexity:
512
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.169g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
330.388g/mol
Monoisotopic Mass:
330.169g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
81.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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