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104700-58-5 | 1-Imidazolidinecarboxamide, N-(1-methylethyl)-2,4-dioxo-3-phenyl-
CAS No: 104700-58-5 Catalog No: AG007GOA MDL No:
Product Description
Catalog Number:
AG007GOA
Chemical Name:
1-Imidazolidinecarboxamide, N-(1-methylethyl)-2,4-dioxo-3-phenyl-
CAS Number:
104700-58-5
Molecular Formula:
C13H15N3O3
Molecular Weight:
261.2765
IUPAC Name:
2,4-dioxo-3-phenyl-N-propan-2-ylimidazolidine-1-carboxamide
InChI:
InChI=1S/C13H15N3O3/c1-9(2)14-12(18)15-8-11(17)16(13(15)19)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,14,18)
InChI Key:
YAPYMCOIVZGZTJ-UHFFFAOYSA-N
SMILES:
CC(NC(=O)N1CC(=O)N(C1=O)c1ccccc1)C
Properties
Complexity:
389
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.111g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
261.281g/mol
Monoisotopic Mass:
261.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
69.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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