![[6-methoxy-8-(methylsulfanylcarbothioylamino)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] methanesulfonate structure](/static/products/6945/6945-62-6.webp)
[6-methoxy-8-(methylsulfanylcarbothioylamino)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] methanesulfonate
TL;DR: [6-methoxy-8-(methylsulfanylcarbothioylamino)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] methanesulfonate (CAS 6945-62-6) is a chemical compound with molecular formula C17H23NO7S3 and molecular weight 449.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-methoxy-8-(methylsulfanylcarbothioylamino)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] methanesulfonate
Also Known As: [6-methoxy-8-(methylsulfanylcarbothioylamino)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] methanesulfonate, Altropyranoside, methyl4,6-O-benzylidene-3-deoxy-3-[(dithiocarboxy)amino]-, methyl ester,methanesulfonate (ester), a-D- (6CI,7CI,8CI), Methyl 4,6-O-benzylidene-3-deoxy-2-O-(methanesulfonyl)-3-{[(methylsulfanyl)carbonothioyl]amino}hexopyranoside
| Molecular Formula | C17H23NO7S3 |
|---|---|
| Molecular Weight | 449.06 g/mol |
| LogP | 1.4228 |
| Topological Polar Surface Area | 92.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 449.06366 |
| Heavy Atoms | 28 |
| Complexity | 776.2155 |
Chemical Identifiers
| CAS Number | 6945-62-6 |
|---|---|
| SMILES | COC1C(C(C2C(O1)COC(O2)C3=CC=CC=C3)NC(=S)SC)OS(=O)(=O)C |
Product Overview
[6-methoxy-8-(methylsulfanylcarbothioylamino)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] methanesulfonate (CAS 6945-62-6), with molecular formula C17H23NO7S3 and molecular weight 449.06 g/mol. IUPAC: [6-methoxy-8-(methylsulfanylcarbothioylamino)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] methanesulfonate.
Chemical Property Profile of [6-methoxy-8-(methylsulfanylcarbothioylamino)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] methanesulfonate
Property Insights of [6-methoxy-8-(methylsulfanylcarbothioylamino)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] methanesulfonate
The XLogP value of 1.4228 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [6-methoxy-8-(methylsulfanylcarbothioylamino)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] methanesulfonate. The TPSA of 92.32 Ų falls within the moderate polarity range, balancing permeability and solubility for [6-methoxy-8-(methylsulfanylcarbothioylamino)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] methanesulfonate. Following Lipinski's Rule of Five, [6-methoxy-8-(methylsulfanylcarbothioylamino)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] methanesulfonate has 1 hydrogen bond donor(s) and 9 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-methoxy-8-(methylsulfanylcarbothioylamino)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] methanesulfonate?
The CAS number of [6-methoxy-8-(methylsulfanylcarbothioylamino)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] methanesulfonate is 6945-62-6.
What is the molecular formula of [6-methoxy-8-(methylsulfanylcarbothioylamino)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] methanesulfonate?
The molecular formula of [6-methoxy-8-(methylsulfanylcarbothioylamino)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] methanesulfonate is C17H23NO7S3.
What is the molecular weight of [6-methoxy-8-(methylsulfanylcarbothioylamino)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] methanesulfonate?
The molecular weight of [6-methoxy-8-(methylsulfanylcarbothioylamino)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] methanesulfonate is 449.06 g/mol.
Where can I buy [6-methoxy-8-(methylsulfanylcarbothioylamino)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] methanesulfonate?
You can request a quote for [6-methoxy-8-(methylsulfanylcarbothioylamino)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] methanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [6-methoxy-8-(methylsulfanylcarbothioylamino)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] methanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for [6-methoxy-8-(methylsulfanylcarbothioylamino)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] methanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.