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80-74-0 | N-((4-Aminophenyl)sulfonyl)-N-(3,4-dimethylisoxazol-5-yl)acetamide
CAS No: 80-74-0 Catalog No: AG003UGS MDL No:
Product Description
Catalog Number:
AG003UGS
Chemical Name:
N-((4-Aminophenyl)sulfonyl)-N-(3,4-dimethylisoxazol-5-yl)acetamide
CAS Number:
80-74-0
Molecular Formula:
C13H15N3O4S
Molecular Weight:
309.3409
IUPAC Name:
N-(4-aminophenyl)sulfonyl-N-(3,4-dimethyl-1,2-oxazol-5-yl)acetamide
InChI:
InChI=1S/C13H15N3O4S/c1-8-9(2)15-20-13(8)16(10(3)17)21(18,19)12-6-4-11(14)5-7-12/h4-7H,14H2,1-3H3
InChI Key:
JFNWFXVFBDDWCX-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)S(=O)(=O)N(c1onc(c1C)C)C(=O)C
EC Number:
201-305-3
UNII:
WBT5QH3KED
Properties
Complexity:
482
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.078g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
309.34g/mol
Monoisotopic Mass:
309.078g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Literature
| Title | Journal |
|---|---|
| Synergistic anti-Pneumocystis carinii effects of erythromycin and sulfisoxazole. | Journal of acquired immune deficiency syndromes 19910101 |
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