4-(ethylsulfonyl)-N-(5-methylisoxazol-3-yl)benzamide
TL;DR: 4-(ethylsulfonyl)-N-(5-methylisoxazol-3-yl)benzamide (CAS 898446-87-2) is a chemical compound with molecular formula C13H14N2O4S and molecular weight 294.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethylsulfonyl-N-(5-methyl-1,2-oxazol-3-yl)benzamide
Also Known As: 4-(ethanesulfonyl)-N-(5-methyl-1,2-oxazol-3-yl)benzamide, 4-(ethylsulfonyl)-N-(5-methylisoxazol-3-yl)benzamide, AB00680422-01, F2648-0686, 4-ethylsulfonyl-N-(5-methyl-1,2-oxazol-3-yl)benzamide
| Molecular Formula | C13H14N2O4S |
|---|---|
| Molecular Weight | 294.07 g/mol |
| LogP | 2.02892 |
| Topological Polar Surface Area | 89.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 294.0674 |
| Heavy Atoms | 20 |
| Complexity | 717.08435 |
Chemical Identifiers
| CAS Number | 898446-87-2 |
|---|---|
| SMILES | CCS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=NOC(=C2)C |
Product Overview
4-(ethylsulfonyl)-N-(5-methylisoxazol-3-yl)benzamide (CAS 898446-87-2), with molecular formula C13H14N2O4S and molecular weight 294.07 g/mol. IUPAC: 4-ethylsulfonyl-N-(5-methyl-1,2-oxazol-3-yl)benzamide.
Chemical Property Profile of 4-(ethylsulfonyl)-N-(5-methylisoxazol-3-yl)benzamide
Property Insights of 4-(ethylsulfonyl)-N-(5-methylisoxazol-3-yl)benzamide
The XLogP value of 2.02892 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(ethylsulfonyl)-N-(5-methylisoxazol-3-yl)benzamide. The TPSA of 89.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(ethylsulfonyl)-N-(5-methylisoxazol-3-yl)benzamide. Following Lipinski's Rule of Five, 4-(ethylsulfonyl)-N-(5-methylisoxazol-3-yl)benzamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(ethylsulfonyl)-N-(5-methylisoxazol-3-yl)benzamide?
The CAS number of 4-(ethylsulfonyl)-N-(5-methylisoxazol-3-yl)benzamide is 898446-87-2.
What is the molecular formula of 4-(ethylsulfonyl)-N-(5-methylisoxazol-3-yl)benzamide?
The molecular formula of 4-(ethylsulfonyl)-N-(5-methylisoxazol-3-yl)benzamide is C13H14N2O4S.
What is the molecular weight of 4-(ethylsulfonyl)-N-(5-methylisoxazol-3-yl)benzamide?
The molecular weight of 4-(ethylsulfonyl)-N-(5-methylisoxazol-3-yl)benzamide is 294.07 g/mol.
Where can I buy 4-(ethylsulfonyl)-N-(5-methylisoxazol-3-yl)benzamide?
You can request a quote for 4-(ethylsulfonyl)-N-(5-methylisoxazol-3-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(ethylsulfonyl)-N-(5-methylisoxazol-3-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(ethylsulfonyl)-N-(5-methylisoxazol-3-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.