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88011-53-4 | Urea, N-[3-(3-ethyl-3-methyl-2,5-dioxo-1-pyrrolidinyl)phenyl]-N'-methyl-
CAS No: 88011-53-4 Catalog No: AG004H07 MDL No:
Product Description
Catalog Number:
AG004H07
Chemical Name:
Urea, N-[3-(3-ethyl-3-methyl-2,5-dioxo-1-pyrrolidinyl)phenyl]-N'-methyl-
CAS Number:
88011-53-4
Molecular Formula:
C15H19N3O3
Molecular Weight:
289.3297
IUPAC Name:
1-[3-(3-ethyl-3-methyl-2,5-dioxopyrrolidin-1-yl)phenyl]-3-methylurea
InChI:
InChI=1S/C15H19N3O3/c1-4-15(2)9-12(19)18(13(15)20)11-7-5-6-10(8-11)17-14(21)16-3/h5-8H,4,9H2,1-3H3,(H2,16,17,21)
InChI Key:
LOOMYDJTLRVILA-UHFFFAOYSA-N
SMILES:
CNC(=O)Nc1cccc(c1)N1C(=O)CC(C1=O)(C)CC
Properties
Complexity:
451
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.143g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
289.335g/mol
Monoisotopic Mass:
289.143g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
78.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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