4-Amino-1lambda6-thiane-1,1-dione hydrochloride
TL;DR: 4-Amino-1lambda6-thiane-1,1-dione hydrochloride (CAS 210240-20-3) is a chemical compound with molecular formula C5H12ClNO2S and molecular weight 185.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-dioxothian-4-amine;hydrochloride
Also Known As: 4-Aminotetrahydro-2H-thiopyran 1,1-dioxide hydrochloride, 1,1-dioxo-4-thianamine, 1,1-dioxothian-4-amine;hydrochloride, 1,1-dioxothian-4-amine hydrochloride, 1,1-dioxo-tetrahydrothiopyran-4-amine hydrochloride
| Molecular Formula | C5H12ClNO2S |
|---|---|
| Molecular Weight | 185.03 g/mol |
| LogP | -0.0559 |
| Topological Polar Surface Area | 68.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 185.02773 |
| Heavy Atoms | 10 |
| Complexity | 166.0 |
Chemical Identifiers
| CAS Number | 210240-20-3 |
|---|---|
| SMILES | C1CS(=O)(=O)CCC1N.Cl |
| InChIKey | XUECUYGAJXDZKG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Amino-1lambda6-thiane-1,1-dione hydrochloride (CAS 210240-20-3), with molecular formula C5H12ClNO2S and molecular weight 185.03 g/mol. IUPAC: 1,1-dioxothian-4-amine;hydrochloride.
Chemical Property Profile of 4-Amino-1lambda6-thiane-1,1-dione hydrochloride
Property Insights of 4-Amino-1lambda6-thiane-1,1-dione hydrochloride
The XLogP value of -0.0559 indicates that 4-Amino-1lambda6-thiane-1,1-dione hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 68.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-1lambda6-thiane-1,1-dione hydrochloride. Following Lipinski's Rule of Five, 4-Amino-1lambda6-thiane-1,1-dione hydrochloride has 2 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 4-Amino-1lambda6-thiane-1,1-dione hydrochloride?
The CAS number of 4-Amino-1lambda6-thiane-1,1-dione hydrochloride is 210240-20-3.
What is the molecular formula of 4-Amino-1lambda6-thiane-1,1-dione hydrochloride?
The molecular formula of 4-Amino-1lambda6-thiane-1,1-dione hydrochloride is C5H12ClNO2S.
What is the molecular weight of 4-Amino-1lambda6-thiane-1,1-dione hydrochloride?
The molecular weight of 4-Amino-1lambda6-thiane-1,1-dione hydrochloride is 185.03 g/mol.
Where can I buy 4-Amino-1lambda6-thiane-1,1-dione hydrochloride?
You can request a quote for 4-Amino-1lambda6-thiane-1,1-dione hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-1lambda6-thiane-1,1-dione hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-1lambda6-thiane-1,1-dione hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.