2H-1,3-Thiazine, tetrahydro-2-butyl-, hydrochloride
TL;DR: 2H-1,3-Thiazine, tetrahydro-2-butyl-, hydrochloride (CAS 79128-39-5) is a chemical compound with molecular formula C8H18ClNS and molecular weight 195.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butyl-1,3-thiazinane;hydrochloride
Also Known As: 2-butyl-1,3-thiazinane hydrochloride, 2-butyl-1,3-thiazinane,hydrochloride, 2-Butyltetrahydro-2H-1,3-thiazine hydrochloride, 2H-1,3-Thiazine, tetrahydro-2-butyl-, hydrochloride, 2-Butyltetrahydro-2H-1,3-thiazinehydrochloride
| Molecular Formula | C8H18ClNS |
|---|---|
| Molecular Weight | 195.08 g/mol |
| LogP | 2.651 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 195.08485 |
| Heavy Atoms | 11 |
| Complexity | 84.16124 |
Chemical Identifiers
| CAS Number | 79128-39-5 |
|---|---|
| SMILES | CCCCC1NCCCS1.Cl |
Product Overview
2H-1,3-Thiazine, tetrahydro-2-butyl-, hydrochloride (CAS 79128-39-5), with molecular formula C8H18ClNS and molecular weight 195.08 g/mol. IUPAC: 2-butyl-1,3-thiazinane;hydrochloride.
Chemical Property Profile of 2H-1,3-Thiazine, tetrahydro-2-butyl-, hydrochloride
Property Insights of 2H-1,3-Thiazine, tetrahydro-2-butyl-, hydrochloride
The XLogP value of 2.651 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1,3-Thiazine, tetrahydro-2-butyl-, hydrochloride. With a topological polar surface area (TPSA) of 12.03 Ų, 2H-1,3-Thiazine, tetrahydro-2-butyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1,3-Thiazine, tetrahydro-2-butyl-, hydrochloride 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 2H-1,3-Thiazine, tetrahydro-2-butyl-, hydrochloride?
The CAS number of 2H-1,3-Thiazine, tetrahydro-2-butyl-, hydrochloride is 79128-39-5.
What is the molecular formula of 2H-1,3-Thiazine, tetrahydro-2-butyl-, hydrochloride?
The molecular formula of 2H-1,3-Thiazine, tetrahydro-2-butyl-, hydrochloride is C8H18ClNS.
What is the molecular weight of 2H-1,3-Thiazine, tetrahydro-2-butyl-, hydrochloride?
The molecular weight of 2H-1,3-Thiazine, tetrahydro-2-butyl-, hydrochloride is 195.08 g/mol.
Where can I buy 2H-1,3-Thiazine, tetrahydro-2-butyl-, hydrochloride?
You can request a quote for 2H-1,3-Thiazine, tetrahydro-2-butyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1,3-Thiazine, tetrahydro-2-butyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2H-1,3-Thiazine, tetrahydro-2-butyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.