4-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]thiomorpholine
TL;DR: 4-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]thiomorpholine (CAS 320422-44-4) is a chemical compound with molecular formula C10H16N2OS and molecular weight 212.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethyl-4-(thiomorpholin-4-ylmethyl)-1,2-oxazole
Also Known As: 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]thiomorpholine, 4-[(3,5-dimethyl-4-isoxazolyl)methyl]thiomorpholine, 12L-510S, 3,5-dimethyl-4-(thiomorpholin-4-ylmethyl)-1,2-oxazole, 3,5-dimethyl-4-(thiomorpholinomethyl)isoxazole
| Molecular Formula | C10H16N2OS |
|---|---|
| Molecular Weight | 212.10 g/mol |
| LogP | 1.84024 |
| Topological Polar Surface Area | 29.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 212.09833 |
| Heavy Atoms | 14 |
| Complexity | 285.57068 |
Chemical Identifiers
| CAS Number | 320422-44-4 |
|---|---|
| SMILES | CC1=C(C(=NO1)C)CN2CCSCC2 |
Product Overview
4-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]thiomorpholine (CAS 320422-44-4), with molecular formula C10H16N2OS and molecular weight 212.10 g/mol. IUPAC: 3,5-dimethyl-4-(thiomorpholin-4-ylmethyl)-1,2-oxazole.
Chemical Property Profile of 4-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]thiomorpholine
Property Insights of 4-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]thiomorpholine
The XLogP value of 1.84024 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]thiomorpholine. With a topological polar surface area (TPSA) of 29.27 Ų, 4-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]thiomorpholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]thiomorpholine 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 4-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]thiomorpholine?
The CAS number of 4-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]thiomorpholine is 320422-44-4.
What is the molecular formula of 4-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]thiomorpholine?
The molecular formula of 4-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]thiomorpholine is C10H16N2OS.
What is the molecular weight of 4-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]thiomorpholine?
The molecular weight of 4-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]thiomorpholine is 212.10 g/mol.
Where can I buy 4-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]thiomorpholine?
You can request a quote for 4-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]thiomorpholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]thiomorpholine?
Yes, KEHONG BIO provides custom synthesis services for 4-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]thiomorpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.