Acetylsulfisomezole
TL;DR: Acetylsulfisomezole (CAS 18607-98-2) is a chemical compound with molecular formula C12H13N3O4S and molecular weight 295.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-aminophenyl)sulfonyl-N-(5-methyl-1,2-oxazol-3-yl)acetamide
Also Known As: N(1)-Acetylsulfamethoxazole, Acetylsulfisomezole, N1-Acetylsulfamethoxazole, N1-Acetylsulfamethoxazol, N-acetylsulfamethoxazole
| Molecular Formula | C12H13N3O4S |
|---|---|
| Molecular Weight | 295.06 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.06268 |
| Heavy Atoms | 20 |
| Complexity | 454.0 |
Chemical Identifiers
| CAS Number | 18607-98-2 |
|---|---|
| SMILES | CC1=CC(=NO1)N(C(=O)C)S(=O)(=O)C2=CC=C(C=C2)N |
| InChIKey | WOTJLXVSBKKTTH-UHFFFAOYSA-N |
Product Overview
Acetylsulfisomezole (CAS 18607-98-2), with molecular formula C12H13N3O4S and molecular weight 295.06 g/mol. IUPAC: N-(4-aminophenyl)sulfonyl-N-(5-methyl-1,2-oxazol-3-yl)acetamide.
Chemical Property Profile of Acetylsulfisomezole
Property Insights of Acetylsulfisomezole
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetylsulfisomezole. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetylsulfisomezole. Following Lipinski's Rule of Five, Acetylsulfisomezole has 1 hydrogen bond donor(s) and 6 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 Acetylsulfisomezole?
The CAS number of Acetylsulfisomezole is 18607-98-2.
What is the molecular formula of Acetylsulfisomezole?
The molecular formula of Acetylsulfisomezole is C12H13N3O4S.
What is the molecular weight of Acetylsulfisomezole?
The molecular weight of Acetylsulfisomezole is 295.06 g/mol.
Where can I buy Acetylsulfisomezole?
You can request a quote for Acetylsulfisomezole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetylsulfisomezole?
Yes, KEHONG BIO provides custom synthesis services for Acetylsulfisomezole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.