2-Butylsulfanyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine
TL;DR: 2-Butylsulfanyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine (CAS 797806-25-8) is a chemical compound with molecular formula C11H21NOS and molecular weight 215.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butylsulfanyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine
Also Known As: BAS 00415358, 2-butylsulfanyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine, 4H-1,3-Oxazine,2-(butylthio)-5,6-dihydro-4,4,6-trimethyl-(9CI), 2-Butylsulfanyl-4,4,6-trimethyl-5,6-dihydro-4H-[1,3]oxazine, 4H-1,3-OXAZINE, 2-(BUTYLTHIO)-5,6-DIHYDRO-4,4,6-TRIMETHYL-
| Molecular Formula | C11H21NOS |
|---|---|
| Molecular Weight | 215.13 g/mol |
| LogP | 3.4631 |
| Topological Polar Surface Area | 21.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 215.13438 |
| Heavy Atoms | 14 |
| Complexity | 213.33307 |
Chemical Identifiers
| CAS Number | 797806-25-8 |
|---|---|
| SMILES | CCCCSC1=NC(CC(O1)C)(C)C |
Product Overview
2-Butylsulfanyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine (CAS 797806-25-8), with molecular formula C11H21NOS and molecular weight 215.13 g/mol. IUPAC: 2-butylsulfanyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine.
Chemical Property Profile of 2-Butylsulfanyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine
Property Insights of 2-Butylsulfanyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine
The XLogP value of 3.4631 indicates that 2-Butylsulfanyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.59 Ų, 2-Butylsulfanyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butylsulfanyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine 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 2-Butylsulfanyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine?
The CAS number of 2-Butylsulfanyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine is 797806-25-8.
What is the molecular formula of 2-Butylsulfanyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine?
The molecular formula of 2-Butylsulfanyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine is C11H21NOS.
What is the molecular weight of 2-Butylsulfanyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine?
The molecular weight of 2-Butylsulfanyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine is 215.13 g/mol.
Where can I buy 2-Butylsulfanyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine?
You can request a quote for 2-Butylsulfanyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butylsulfanyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine?
Yes, KEHONG BIO provides custom synthesis services for 2-Butylsulfanyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.