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114066-89-6 | 2,4(1H,3H)-Pyrimidinedione, 5-methyl-1,3-di-2-propen-1-yl-
CAS No: 114066-89-6 Catalog No: AG000AG1 MDL No:
Product Description
Catalog Number:
AG000AG1
Chemical Name:
2,4(1H,3H)-Pyrimidinedione, 5-methyl-1,3-di-2-propen-1-yl-
CAS Number:
114066-89-6
Molecular Formula:
C11H14N2O2
Molecular Weight:
206.2411
IUPAC Name:
5-methyl-1,3-bis(prop-2-enyl)pyrimidine-2,4-dione
InChI:
InChI=1S/C11H14N2O2/c1-4-6-12-8-9(3)10(14)13(7-5-2)11(12)15/h4-5,8H,1-2,6-7H2,3H3
InChI Key:
LPHRAHGTESHZNN-UHFFFAOYSA-N
SMILES:
C=CCn1cc(C)c(=O)n(c1=O)CC=C
Properties
Complexity:
345
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.106g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.245g/mol
Monoisotopic Mass:
206.106g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
0
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 |
| Potentiating effects of N1,N3-diallyluracil, N1,N3-diallylthymine and N1,N3-diallyl-6-methyluracil on pentobarbital-induced sleep and diazepam-induced motor incoordination. | Chemical & pharmaceutical bulletin 19871201 |
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