3-(4-Methylphenyl)sulfonyl-1,3-benzoxazol-2-one
TL;DR: 3-(4-Methylphenyl)sulfonyl-1,3-benzoxazol-2-one (CAS 292826-49-4) is a chemical compound with molecular formula C14H11NO4S and molecular weight 289.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methylphenyl)sulfonyl-1,3-benzoxazol-2-one
Also Known As: 3-(4-methylphenyl)sulfonyl-1,3-benzoxazol-2-one, 3-tosylbenzo[d]oxazol-2(3H)-one, 3-[(4-methylphenyl)sulfonyl]-1,3-benzoxazol-2(3H)-one, 3-tosyl-1,3-benzoxazolidin-2(3H)-one, AH-357/03444012
| Molecular Formula | C14H11NO4S |
|---|---|
| Molecular Weight | 289.04 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 289.0409 |
| Heavy Atoms | 20 |
| Complexity | 476.0 |
Chemical Identifiers
| CAS Number | 292826-49-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3OC2=O |
| InChIKey | GFWJFUAUJKMTEJ-UHFFFAOYSA-N |
Product Overview
3-(4-Methylphenyl)sulfonyl-1,3-benzoxazol-2-one (CAS 292826-49-4), with molecular formula C14H11NO4S and molecular weight 289.04 g/mol. IUPAC: 3-(4-methylphenyl)sulfonyl-1,3-benzoxazol-2-one.
Chemical Property Profile of 3-(4-Methylphenyl)sulfonyl-1,3-benzoxazol-2-one
Property Insights of 3-(4-Methylphenyl)sulfonyl-1,3-benzoxazol-2-one
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Methylphenyl)sulfonyl-1,3-benzoxazol-2-one. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Methylphenyl)sulfonyl-1,3-benzoxazol-2-one. Following Lipinski's Rule of Five, 3-(4-Methylphenyl)sulfonyl-1,3-benzoxazol-2-one has 0 hydrogen bond donor(s) and 4 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 3-(4-Methylphenyl)sulfonyl-1,3-benzoxazol-2-one?
The CAS number of 3-(4-Methylphenyl)sulfonyl-1,3-benzoxazol-2-one is 292826-49-4.
What is the molecular formula of 3-(4-Methylphenyl)sulfonyl-1,3-benzoxazol-2-one?
The molecular formula of 3-(4-Methylphenyl)sulfonyl-1,3-benzoxazol-2-one is C14H11NO4S.
What is the molecular weight of 3-(4-Methylphenyl)sulfonyl-1,3-benzoxazol-2-one?
The molecular weight of 3-(4-Methylphenyl)sulfonyl-1,3-benzoxazol-2-one is 289.04 g/mol.
Where can I buy 3-(4-Methylphenyl)sulfonyl-1,3-benzoxazol-2-one?
You can request a quote for 3-(4-Methylphenyl)sulfonyl-1,3-benzoxazol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Methylphenyl)sulfonyl-1,3-benzoxazol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Methylphenyl)sulfonyl-1,3-benzoxazol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.