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Home > Imidazoles > 892-02-4
892-02-4 | 2,4-Imidazolidinedione,5-[(3,4-dimethoxyphenyl)methyl]-5-methyl-
CAS No: 892-02-4 Catalog No: AG00893G MDL No:
Product Description
Catalog Number:
AG00893G
Chemical Name:
2,4-Imidazolidinedione,5-[(3,4-dimethoxyphenyl)methyl]-5-methyl-
CAS Number:
892-02-4
Molecular Formula:
C13H16N2O4
Molecular Weight:
264.2771
IUPAC Name:
5-[(3,4-dimethoxyphenyl)methyl]-5-methylimidazolidine-2,4-dione
InChI:
InChI=1S/C13H16N2O4/c1-13(11(16)14-12(17)15-13)7-8-4-5-9(18-2)10(6-8)19-3/h4-6H,7H2,1-3H3,(H2,14,15,16,17)
InChI Key:
LMCMSORQDRGJLG-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OC)CC1(C)NC(=O)NC1=O
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.111g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
264.281g/mol
Monoisotopic Mass:
264.111g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
76.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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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