Bis(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)octasulfane-1,8-diylbis(methylcarbamate)
TL;DR: Bis(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)octasulfane-1,8-diylbis(methylcarbamate) (CAS 79451-09-5) is a chemical compound with molecular formula C24H28N2O6S8 and molecular weight 695.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,2-dimethyl-3H-1-benzofuran-7-yl) N-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]octasulfanyl]-N-methylcarbamate
Also Known As: Bis(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)octasulfane-1,8-diylbis(methylcarbamate), bis(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl) octasulfane-1,8-diylbis(methylcarbamate), Bis[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)] octasulfane-1,8-diylbis(methylcarbamate), Carbamic acid, octathiobis(methyl-, bis(2,3-dihydro-2,2-dimethyl-7-benzofuranyl) ester, (2,2-dimethyl-3H-1-benzofuran-7-yl) N-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]octasulfanyl]-N-methylcarbamate
| Molecular Formula | C24H28N2O6S8 |
|---|---|
| Molecular Weight | 695.97 g/mol |
| LogP | 8.3 |
| Topological Polar Surface Area | 280.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 13 |
| Exact Mass | 695.9713 |
| Heavy Atoms | 40 |
| Complexity | 805.0 |
Chemical Identifiers
| CAS Number | 79451-09-5 |
|---|---|
| SMILES | CC1(CC2=C(O1)C(=CC=C2)OC(=O)N(C)SSSSSSSSN(C)C(=O)OC3=CC=CC4=C3OC(C4)(C)C)C |
| InChIKey | FXSHPSIDBNISNJ-UHFFFAOYSA-N |
Product Overview
Bis(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)octasulfane-1,8-diylbis(methylcarbamate) (CAS 79451-09-5), with molecular formula C24H28N2O6S8 and molecular weight 695.97 g/mol. IUPAC: (2,2-dimethyl-3H-1-benzofuran-7-yl) N-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]octasulfanyl]-N-methylcarbamate.
Chemical Property Profile of Bis(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)octasulfane-1,8-diylbis(methylcarbamate)
Property Insights of Bis(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)octasulfane-1,8-diylbis(methylcarbamate)
The XLogP value of 8.3 indicates that Bis(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)octasulfane-1,8-diylbis(methylcarbamate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 280.0 Ų indicates high polarity, suggesting Bis(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)octasulfane-1,8-diylbis(methylcarbamate) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Bis(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)octasulfane-1,8-diylbis(methylcarbamate) has 0 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bis(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)octasulfane-1,8-diylbis(methylcarbamate)?
The CAS number of Bis(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)octasulfane-1,8-diylbis(methylcarbamate) is 79451-09-5.
What is the molecular formula of Bis(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)octasulfane-1,8-diylbis(methylcarbamate)?
The molecular formula of Bis(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)octasulfane-1,8-diylbis(methylcarbamate) is C24H28N2O6S8.
What is the molecular weight of Bis(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)octasulfane-1,8-diylbis(methylcarbamate)?
The molecular weight of Bis(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)octasulfane-1,8-diylbis(methylcarbamate) is 695.97 g/mol.
Where can I buy Bis(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)octasulfane-1,8-diylbis(methylcarbamate)?
You can request a quote for Bis(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)octasulfane-1,8-diylbis(methylcarbamate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)octasulfane-1,8-diylbis(methylcarbamate)?
Yes, KEHONG BIO provides custom synthesis services for Bis(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)octasulfane-1,8-diylbis(methylcarbamate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.