![methyl N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)carbamodithioate structure](/static/products/6635/6635-77-4.webp)
methyl N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)carbamodithioate
TL;DR: methyl N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)carbamodithioate (CAS 6635-77-4) is a chemical compound with molecular formula C16H21NO5S2 and molecular weight 371.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)carbamodithioate
Also Known As: methyl N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)carbamodithioate, Methyl 4,6-O-benzylidene-3-deoxy-3-{[(methylsulfanyl)carbonothioyl]amino}hexopyranoside
| Molecular Formula | C16H21NO5S2 |
|---|---|
| Molecular Weight | 371.09 g/mol |
| LogP | 1.4389 |
| Topological Polar Surface Area | 69.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 371.08612 |
| Heavy Atoms | 24 |
| Complexity | 560.65857 |
Chemical Identifiers
| CAS Number | 6635-77-4 |
|---|---|
| SMILES | COC1C(C(C2C(O1)COC(O2)C3=CC=CC=C3)NC(=S)SC)O |
Product Overview
methyl N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)carbamodithioate (CAS 6635-77-4), with molecular formula C16H21NO5S2 and molecular weight 371.09 g/mol. IUPAC: methyl N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)carbamodithioate.
Chemical Property Profile of methyl N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)carbamodithioate
Property Insights of methyl N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)carbamodithioate
The XLogP value of 1.4389 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)carbamodithioate. The TPSA of 69.18 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)carbamodithioate. Following Lipinski's Rule of Five, methyl N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)carbamodithioate has 2 hydrogen bond donor(s) and 7 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 methyl N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)carbamodithioate?
The CAS number of methyl N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)carbamodithioate is 6635-77-4.
What is the molecular formula of methyl N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)carbamodithioate?
The molecular formula of methyl N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)carbamodithioate is C16H21NO5S2.
What is the molecular weight of methyl N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)carbamodithioate?
The molecular weight of methyl N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)carbamodithioate is 371.09 g/mol.
Where can I buy methyl N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)carbamodithioate?
You can request a quote for methyl N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)carbamodithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)carbamodithioate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)carbamodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.