![4,4-Dimethyl-3-[(4-methylphenyl)sulfonyl]-1,3-oxazolane structure](/static/products/866/866157-32-6.png)
4,4-Dimethyl-3-[(4-methylphenyl)sulfonyl]-1,3-oxazolane
TL;DR: 4,4-Dimethyl-3-[(4-methylphenyl)sulfonyl]-1,3-oxazolane (CAS 866157-32-6) is a chemical compound with molecular formula C12H17NO3S and molecular weight 255.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-dimethyl-3-(4-methylphenyl)sulfonyl-1,3-oxazolidine
Also Known As: 4,4-dimethyl-3-(4-methylbenzenesulfonyl)-1,3-oxazolidine, 4,4-dimethyl-3-[(4-methylphenyl)sulfonyl]-1,3-oxazolane, 4,4-dimethyl-3-(p-tolylsulfonyl)oxazolidine, 4,4-dimethyl-3-(4-methylphenyl)sulfonyl-1,3-oxazolidine
| Molecular Formula | C12H17NO3S |
|---|---|
| Molecular Weight | 255.09 g/mol |
| LogP | 1.75202 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 255.09291 |
| Heavy Atoms | 17 |
| Complexity | 505.05722 |
Chemical Identifiers
| CAS Number | 866157-32-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2COCC2(C)C |
Product Overview
4,4-Dimethyl-3-[(4-methylphenyl)sulfonyl]-1,3-oxazolane (CAS 866157-32-6), with molecular formula C12H17NO3S and molecular weight 255.09 g/mol. IUPAC: 4,4-dimethyl-3-(4-methylphenyl)sulfonyl-1,3-oxazolidine.
Chemical Property Profile of 4,4-Dimethyl-3-[(4-methylphenyl)sulfonyl]-1,3-oxazolane
Property Insights of 4,4-Dimethyl-3-[(4-methylphenyl)sulfonyl]-1,3-oxazolane
The XLogP value of 1.75202 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4-Dimethyl-3-[(4-methylphenyl)sulfonyl]-1,3-oxazolane. With a topological polar surface area (TPSA) of 46.61 Ų, 4,4-Dimethyl-3-[(4-methylphenyl)sulfonyl]-1,3-oxazolane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4-Dimethyl-3-[(4-methylphenyl)sulfonyl]-1,3-oxazolane has 0 hydrogen bond donor(s) and 3 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 4,4-Dimethyl-3-[(4-methylphenyl)sulfonyl]-1,3-oxazolane?
The CAS number of 4,4-Dimethyl-3-[(4-methylphenyl)sulfonyl]-1,3-oxazolane is 866157-32-6.
What is the molecular formula of 4,4-Dimethyl-3-[(4-methylphenyl)sulfonyl]-1,3-oxazolane?
The molecular formula of 4,4-Dimethyl-3-[(4-methylphenyl)sulfonyl]-1,3-oxazolane is C12H17NO3S.
What is the molecular weight of 4,4-Dimethyl-3-[(4-methylphenyl)sulfonyl]-1,3-oxazolane?
The molecular weight of 4,4-Dimethyl-3-[(4-methylphenyl)sulfonyl]-1,3-oxazolane is 255.09 g/mol.
Where can I buy 4,4-Dimethyl-3-[(4-methylphenyl)sulfonyl]-1,3-oxazolane?
You can request a quote for 4,4-Dimethyl-3-[(4-methylphenyl)sulfonyl]-1,3-oxazolane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4-Dimethyl-3-[(4-methylphenyl)sulfonyl]-1,3-oxazolane?
Yes, KEHONG BIO provides custom synthesis services for 4,4-Dimethyl-3-[(4-methylphenyl)sulfonyl]-1,3-oxazolane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.