RefChem:215595
TL;DR: RefChem:215595 (CAS 59826-54-9) is a chemical compound with molecular formula C13H11N3O5S and molecular weight 321.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-methyl-1,2-oxazol-3-yl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide
Also Known As: 1,2-Benzisothiazole-2(3H)-acetamide, N-(5-methyl-3-isoxazolyl)-3-oxo-, 1,1-dioxide, 2-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide, N-(5-methyl-1,2-oxazol-3-yl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide, 2,3,dihydro-N-(5-methyl-3-isoxazolyl)-3-oxo-1,2-benzisothiazole-2-acetamide 1,1-dioxide, 2,3-dihydro-N-(5-methyl-3-isoxazolyl)-3-oxo-1,2-benzisothiazole-2-acetamide 1,1-dioxide
| Molecular Formula | C13H11N3O5S |
|---|---|
| Molecular Weight | 321.04 g/mol |
| LogP | 0.76622 |
| Topological Polar Surface Area | 109.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 321.04193 |
| Heavy Atoms | 22 |
| Complexity | 871.30566 |
Chemical Identifiers
| CAS Number | 59826-54-9 |
|---|---|
| SMILES | CC1=CC(=NO1)NC(=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O |
Product Overview
RefChem:215595 (CAS 59826-54-9), with molecular formula C13H11N3O5S and molecular weight 321.04 g/mol. IUPAC: N-(5-methyl-1,2-oxazol-3-yl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide.
Chemical Property Profile of RefChem:215595
Property Insights of RefChem:215595
The XLogP value of 0.76622 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:215595. The TPSA of 109.58 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:215595. Following Lipinski's Rule of Five, RefChem:215595 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 RefChem:215595?
The CAS number of RefChem:215595 is 59826-54-9.
What is the molecular formula of RefChem:215595?
The molecular formula of RefChem:215595 is C13H11N3O5S.
What is the molecular weight of RefChem:215595?
The molecular weight of RefChem:215595 is 321.04 g/mol.
Where can I buy RefChem:215595?
You can request a quote for RefChem:215595 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:215595?
Yes, KEHONG BIO provides custom synthesis services for RefChem:215595 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.