Free Chemical Databases
-
[Synonyms]
NSC42004
T0517-3169
6308-24-3
[Structure]
[ Properties Computed from Structure]
Molecular Weight 238.67024 [g/mol] Molecular Formula C11H11ClN2O2 XLogP 1.8 H-Bond Donor 2 H-Bond Acceptor 2 Rotatable Bond Count 2 Tautomer Count 5 Exact Mass 238.050905 MonoIsotopic Mass 238.050905 Topological Polar Surface Area 58.2 Heavy Atom Count 16 Formal Charge 0 Complexity 313 Isotope Atom Count 0 Defined Atom StereoCenter Count 0 Undefined Atom StereoCenter Count 1 Defined Bond StereoCenter Count 0 Undefined Bond StereoCenter Count 0 Covalently-Bonded Unit Count 1
[ Descriptors Computed from Structure]
IUPAC Name: 5-(4-chlorophenyl)-5-ethylimidazolidine-2,4-dione
Canonical SMILES: CCC1(C(=O)NC(=O)N1)C2=CC=C(C=C2)Cl
InChI: InChI=1/C11H11ClN2O2/c1-2-11(9(15)13-10(16)14-11)7-3-5-8(12)6-4-7/h3-6H,
2H2,1H3,(H2,13,14,15,16)/f/h13-14H
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