N-((4-(5-Methyl-3-phenylisoxazol-4-yl)phenyl)sulfonyl)acetaMide
- CAS NO.：198471-06-6
- Empirical Formula: C18H16N2O4S
- Molecular Weight: 356.4
- MDL number: MFCD26940316
- SAFETY DATA SHEET (SDS)
- Update Date: 2023-04-27 16:27:43
What is N-((4-(5-Methyl-3-phenylisoxazol-4-yl)phenyl)sulfonyl)acetaMide?
The Uses of N-((4-(5-Methyl-3-phenylisoxazol-4-yl)phenyl)sulfonyl)acetaMide
N-[[4-(5-Methyl-3-phenyl-4-isoxazolyl)phenyl]sulfonyl]acetamide is used in the microbial biotransformations of valdecoxib using microbial cultures to predict mammalian drug metabolism.
Properties of N-((4-(5-Methyl-3-phenylisoxazol-4-yl)phenyl)sulfonyl)acetaMide
| Density | 1.288±0.06 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| pka | 5.10±0.10(Predicted) |
| InChI | InChI=1S/C18H16N2O4S/c1-12-17(18(19-24-12)15-6-4-3-5-7-15)14-8-10-16(11-9-14)25(22,23)20-13(2)21/h3-11H,1-2H3,(H,20,21) |
Safety information for N-((4-(5-Methyl-3-phenylisoxazol-4-yl)phenyl)sulfonyl)acetaMide
Computed Descriptors for N-((4-(5-Methyl-3-phenylisoxazol-4-yl)phenyl)sulfonyl)acetaMide
| InChIKey | UMBILIGVYYXBRD-UHFFFAOYSA-N |
| SMILES | C(NS(C1=CC=C(C2=C(C)ON=C2C2=CC=CC=C2)C=C1)(=O)=O)(=O)C |
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