6-methyl-4-pyrrolidin-1-yl-4,5,7,8-tetrahydro-3H-oxathiino[5,6-c]pyridine 2,2-dioxide
TL;DR: 6-methyl-4-pyrrolidin-1-yl-4,5,7,8-tetrahydro-3H-oxathiino[5,6-c]pyridine 2,2-dioxide (CAS 70027-72-4) is a chemical compound with molecular formula C12H20N2O3S and molecular weight 272.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-4-pyrrolidin-1-yl-4,5,7,8-tetrahydro-3H-oxathiino[5,6-c]pyridine 2,2-dioxide
Also Known As: 6-methyl-4-pyrrolidin-1-yl-4,5,7,8-tetrahydro-3H-oxathiino[5,6-c]pyridine 2,2-dioxide, 6-methyl-4-pyrrolidin-1-yl-4,5,7,8-tetrahydro-3H-oxathiino[5, 6-Methyl-4-(pyrrolidin-1-yl)-3,4,5,6,7,8-hexahydro-2H-2lambda~6~-[1,2]oxathiino[5,6-c]pyridine-2,2-dione
| Molecular Formula | C12H20N2O3S |
|---|---|
| Molecular Weight | 272.12 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 272.11948 |
| Heavy Atoms | 18 |
| Complexity | 460.0 |
Chemical Identifiers
| CAS Number | 70027-72-4 |
|---|---|
| SMILES | CN1CCC2=C(C1)C(CS(=O)(=O)O2)N3CCCC3 |
| InChIKey | OFCJTGQIOOZJKV-UHFFFAOYSA-N |
Product Overview
6-methyl-4-pyrrolidin-1-yl-4,5,7,8-tetrahydro-3H-oxathiino[5,6-c]pyridine 2,2-dioxide (CAS 70027-72-4), with molecular formula C12H20N2O3S and molecular weight 272.12 g/mol. IUPAC: 6-methyl-4-pyrrolidin-1-yl-4,5,7,8-tetrahydro-3H-oxathiino[5,6-c]pyridine 2,2-dioxide.
Chemical Property Profile of 6-methyl-4-pyrrolidin-1-yl-4,5,7,8-tetrahydro-3H-oxathiino[5,6-c]pyridine 2,2-dioxide
Property Insights of 6-methyl-4-pyrrolidin-1-yl-4,5,7,8-tetrahydro-3H-oxathiino[5,6-c]pyridine 2,2-dioxide
The XLogP value of -0.1 indicates that 6-methyl-4-pyrrolidin-1-yl-4,5,7,8-tetrahydro-3H-oxathiino[5,6-c]pyridine 2,2-dioxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 58.2 Ų, 6-methyl-4-pyrrolidin-1-yl-4,5,7,8-tetrahydro-3H-oxathiino[5,6-c]pyridine 2,2-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-methyl-4-pyrrolidin-1-yl-4,5,7,8-tetrahydro-3H-oxathiino[5,6-c]pyridine 2,2-dioxide has 0 hydrogen bond donor(s) and 5 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 6-methyl-4-pyrrolidin-1-yl-4,5,7,8-tetrahydro-3H-oxathiino[5,6-c]pyridine 2,2-dioxide?
The CAS number of 6-methyl-4-pyrrolidin-1-yl-4,5,7,8-tetrahydro-3H-oxathiino[5,6-c]pyridine 2,2-dioxide is 70027-72-4.
What is the molecular formula of 6-methyl-4-pyrrolidin-1-yl-4,5,7,8-tetrahydro-3H-oxathiino[5,6-c]pyridine 2,2-dioxide?
The molecular formula of 6-methyl-4-pyrrolidin-1-yl-4,5,7,8-tetrahydro-3H-oxathiino[5,6-c]pyridine 2,2-dioxide is C12H20N2O3S.
What is the molecular weight of 6-methyl-4-pyrrolidin-1-yl-4,5,7,8-tetrahydro-3H-oxathiino[5,6-c]pyridine 2,2-dioxide?
The molecular weight of 6-methyl-4-pyrrolidin-1-yl-4,5,7,8-tetrahydro-3H-oxathiino[5,6-c]pyridine 2,2-dioxide is 272.12 g/mol.
Where can I buy 6-methyl-4-pyrrolidin-1-yl-4,5,7,8-tetrahydro-3H-oxathiino[5,6-c]pyridine 2,2-dioxide?
You can request a quote for 6-methyl-4-pyrrolidin-1-yl-4,5,7,8-tetrahydro-3H-oxathiino[5,6-c]pyridine 2,2-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-methyl-4-pyrrolidin-1-yl-4,5,7,8-tetrahydro-3H-oxathiino[5,6-c]pyridine 2,2-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 6-methyl-4-pyrrolidin-1-yl-4,5,7,8-tetrahydro-3H-oxathiino[5,6-c]pyridine 2,2-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.