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Home > Sulfanilamide > 114072-05-8
114072-05-8 | Benzenesulfonamide, N-(2,3-dihydro-2-oxo-4-pyrimidinyl)-4-methyl-
CAS No: 114072-05-8 Catalog No: AG000AGH MDL No:
Product Description
Catalog Number:
AG000AGH
Chemical Name:
Benzenesulfonamide, N-(2,3-dihydro-2-oxo-4-pyrimidinyl)-4-methyl-
CAS Number:
114072-05-8
Molecular Formula:
C11H11N3O3S
Molecular Weight:
265.2883
IUPAC Name:
4-methyl-N-(2-oxo-1H-pyrimidin-6-yl)benzenesulfonamide
InChI:
InChI=1S/C11H11N3O3S/c1-8-2-4-9(5-3-8)18(16,17)14-10-6-7-12-11(15)13-10/h2-7H,1H3,(H2,12,13,14,15)
InChI Key:
QISVMUZOXYILIB-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)Nc1ccnc(=O)[nH]1
Properties
Complexity:
482
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.052g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
265.287g/mol
Monoisotopic Mass:
265.052g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
96A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
Literature
| Title | Journal |
|---|---|
| New cytosine derivatives as inhibitors of DNA methylation. | European journal of medicinal chemistry 20120901 |
| Synthesis of modified pyrimidine bases and positive impact of chemically reactive substituents on their in vitro antiproliferative activity. | European journal of medicinal chemistry 20090301 |
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