2-Propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol
TL;DR: 2-Propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol (CAS 69226-22-8) is a chemical compound with molecular formula C7H13NOS and molecular weight 159.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-propylmorpholine-3-thione
Also Known As: 2-Propyl-3-thiomorpholinone, 3-Thiomorpholinone, 2-propyl-, 2-propylmorpholine-3-thione, 2-Propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol, 4-27-00-02570 (Beilstein Handbook Reference)
| Molecular Formula | C7H13NOS |
|---|---|
| Molecular Weight | 159.07 g/mol |
| LogP | 1.1023 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 159.0718 |
| Heavy Atoms | 10 |
| Complexity | 124.77451 |
Chemical Identifiers
| CAS Number | 69226-22-8 |
|---|---|
| SMILES | CCCC1C(=S)NCCO1 |
Product Overview
2-Propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol (CAS 69226-22-8), with molecular formula C7H13NOS and molecular weight 159.07 g/mol. IUPAC: 2-propylmorpholine-3-thione.
Chemical Property Profile of 2-Propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol
Property Insights of 2-Propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol
The XLogP value of 1.1023 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol. With a topological polar surface area (TPSA) of 21.26 Ų, 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, 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 2-Propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol?
The CAS number of 2-Propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol is 69226-22-8.
What is the molecular formula of 2-Propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol?
The molecular formula of 2-Propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol is C7H13NOS.
What is the molecular weight of 2-Propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol?
The molecular weight of 2-Propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol is 159.07 g/mol.
Where can I buy 2-Propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol?
You can request a quote for 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 2-Propyl-5,6-dihydro-2H-1,4-oxazine-3-thiol?
Yes, KEHONG BIO provides custom synthesis services for 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.