7-azido-8-benzylsulfanyl-6-methoxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine
TL;DR: 7-azido-8-benzylsulfanyl-6-methoxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine (CAS 6958-04-9) is a chemical compound with molecular formula C16H21N3O4S and molecular weight 351.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-azido-8-benzylsulfanyl-6-methoxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine
Also Known As: 7-azido-8-benzylsulfanyl-6-methoxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine, Methyl 2-azido-3-S-benzyl-2-deoxy-4,6-O-ethylidene-3-thiohexopyranoside, 3-azido-2-benzylsulfanyl-4-methoxy-9-methyl-5,8,10-trioxabicyclo[4.4.0]decane
| Molecular Formula | C16H21N3O4S |
|---|---|
| Molecular Weight | 351.13 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 85.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 351.12527 |
| Heavy Atoms | 24 |
| Complexity | 583.94507 |
Chemical Identifiers
| CAS Number | 6958-04-9 |
|---|---|
| SMILES | CC1OCC2C(O1)C(C(C(O2)OC)N=[N+]=[N-])SCC3=CC=CC=C3 |
Product Overview
7-azido-8-benzylsulfanyl-6-methoxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine (CAS 6958-04-9), with molecular formula C16H21N3O4S and molecular weight 351.13 g/mol. IUPAC: 7-azido-8-benzylsulfanyl-6-methoxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine.
Chemical Property Profile of 7-azido-8-benzylsulfanyl-6-methoxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine
Property Insights of 7-azido-8-benzylsulfanyl-6-methoxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine
The XLogP value of 3.1 indicates that 7-azido-8-benzylsulfanyl-6-methoxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-azido-8-benzylsulfanyl-6-methoxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine. Following Lipinski's Rule of Five, 7-azido-8-benzylsulfanyl-6-methoxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine has 0 hydrogen bond donor(s) and 6 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 7-azido-8-benzylsulfanyl-6-methoxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine?
The CAS number of 7-azido-8-benzylsulfanyl-6-methoxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine is 6958-04-9.
What is the molecular formula of 7-azido-8-benzylsulfanyl-6-methoxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine?
The molecular formula of 7-azido-8-benzylsulfanyl-6-methoxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine is C16H21N3O4S.
What is the molecular weight of 7-azido-8-benzylsulfanyl-6-methoxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine?
The molecular weight of 7-azido-8-benzylsulfanyl-6-methoxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine is 351.13 g/mol.
Where can I buy 7-azido-8-benzylsulfanyl-6-methoxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine?
You can request a quote for 7-azido-8-benzylsulfanyl-6-methoxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-azido-8-benzylsulfanyl-6-methoxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine?
Yes, KEHONG BIO provides custom synthesis services for 7-azido-8-benzylsulfanyl-6-methoxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.