![methyl 4-[(3-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)sulfonyl]phenyl ether structure](/static/products/3387/338747-49-2.webp)
methyl 4-[(3-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)sulfonyl]phenyl ether
TL;DR: methyl 4-[(3-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)sulfonyl]phenyl ether (CAS 338747-49-2) is a chemical compound with molecular formula C16H17NO4S and molecular weight 319.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methoxyphenyl)sulfonyl-3-methyl-2,3-dihydro-1,4-benzoxazine
Also Known As: methyl 4-[(3-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)sulfonyl]phenyl ether, 4-(4-methoxyphenyl)sulfonyl-3-methyl-2,3-dihydro-1,4-benzoxazine, 4-(4-methoxybenzenesulfonyl)-3-methyl-3,4-dihydro-2H-1,4-benzoxazine, VU0289872-2, 4-(4-methoxybenzenesulfonyl)-3-methyl-2,3-dihydro-1,4-benzoxazine
| Molecular Formula | C16H17NO4S |
|---|---|
| Molecular Weight | 319.09 g/mol |
| LogP | 2.6714 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 319.08783 |
| Heavy Atoms | 22 |
| Complexity | 770.98773 |
Chemical Identifiers
| CAS Number | 338747-49-2 |
|---|---|
| SMILES | CC1COC2=CC=CC=C2N1S(=O)(=O)C3=CC=C(C=C3)OC |
Product Overview
methyl 4-[(3-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)sulfonyl]phenyl ether (CAS 338747-49-2), with molecular formula C16H17NO4S and molecular weight 319.09 g/mol. IUPAC: 4-(4-methoxyphenyl)sulfonyl-3-methyl-2,3-dihydro-1,4-benzoxazine.
Chemical Property Profile of methyl 4-[(3-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)sulfonyl]phenyl ether
Property Insights of methyl 4-[(3-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)sulfonyl]phenyl ether
The XLogP value of 2.6714 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 4-[(3-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)sulfonyl]phenyl ether. With a topological polar surface area (TPSA) of 55.84 Ų, methyl 4-[(3-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)sulfonyl]phenyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 4-[(3-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)sulfonyl]phenyl ether 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 methyl 4-[(3-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)sulfonyl]phenyl ether?
The CAS number of methyl 4-[(3-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)sulfonyl]phenyl ether is 338747-49-2.
What is the molecular formula of methyl 4-[(3-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)sulfonyl]phenyl ether?
The molecular formula of methyl 4-[(3-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)sulfonyl]phenyl ether is C16H17NO4S.
What is the molecular weight of methyl 4-[(3-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)sulfonyl]phenyl ether?
The molecular weight of methyl 4-[(3-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)sulfonyl]phenyl ether is 319.09 g/mol.
Where can I buy methyl 4-[(3-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)sulfonyl]phenyl ether?
You can request a quote for methyl 4-[(3-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)sulfonyl]phenyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-[(3-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)sulfonyl]phenyl ether?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-[(3-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)sulfonyl]phenyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.