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Home > Imidazoles > 34657-68-6
34657-68-6 | 3-Benzyl-5,5-dimethyl-2,4-imidazolidinedione
CAS No: 34657-68-6 Catalog No: AG01EVMJ MDL No:
Product Description
Catalog Number:
AG01EVMJ
Chemical Name:
3-Benzyl-5,5-dimethyl-2,4-imidazolidinedione
CAS Number:
34657-68-6
Molecular Formula:
C12H14N2O2
Molecular Weight:
218.2518
IUPAC Name:
3-benzyl-5,5-dimethylimidazolidine-2,4-dione
InChI:
InChI=1S/C12H14N2O2/c1-12(2)10(15)14(11(16)13-12)8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H,13,16)
InChI Key:
DSBMOVYUOIIPDK-UHFFFAOYSA-N
SMILES:
O=C1NC(C(=O)N1Cc1ccccc1)(C)C
NSC Number:
150476
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.106g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
218.256g/mol
Monoisotopic Mass:
218.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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