5-Methyl-2-propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol
TL;DR: 5-Methyl-2-propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol (CAS 69226-21-7) is a chemical compound with molecular formula C8H15NOS and molecular weight 173.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-2-propylmorpholine-3-thione
Also Known As: 5-Methyl-2-propyl-3-thiomorpholinone, 3-Thiomorpholinone, 5-methyl-2-propyl-, 5-methyl-2-propylmorpholine-3-thione, 4-27-00-02573 (Beilstein Handbook Reference), 5-Methyl-2-propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol
| Molecular Formula | C8H15NOS |
|---|---|
| Molecular Weight | 173.09 g/mol |
| LogP | 1.4908 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 173.08743 |
| Heavy Atoms | 11 |
| Complexity | 149.02748 |
Chemical Identifiers
| CAS Number | 69226-21-7 |
|---|---|
| SMILES | CCCC1C(=S)NC(CO1)C |
Product Overview
5-Methyl-2-propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol (CAS 69226-21-7), with molecular formula C8H15NOS and molecular weight 173.09 g/mol. IUPAC: 5-methyl-2-propylmorpholine-3-thione.
Chemical Property Profile of 5-Methyl-2-propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol
Property Insights of 5-Methyl-2-propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol
The XLogP value of 1.4908 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methyl-2-propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol. With a topological polar surface area (TPSA) of 21.26 Ų, 5-Methyl-2-propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methyl-2-propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol has 1 hydrogen bond donor(s) and 2 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 5-Methyl-2-propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol?
The CAS number of 5-Methyl-2-propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol is 69226-21-7.
What is the molecular formula of 5-Methyl-2-propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol?
The molecular formula of 5-Methyl-2-propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol is C8H15NOS.
What is the molecular weight of 5-Methyl-2-propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol?
The molecular weight of 5-Methyl-2-propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol is 173.09 g/mol.
Where can I buy 5-Methyl-2-propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol?
You can request a quote for 5-Methyl-2-propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-2-propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-2-propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.