TL;DR: Ethyl 2,3-Di-O-(4-Methoxybenzy)-4,6-(4-methoxybenzylidene)-beta-D-thiogalactopyranoside (CAS 1041171-02-1) is a chemical compound with molecular formula C32H38O10S and molecular weight 614.21857 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[7,8-bis[(4-methoxyphenoxy)methoxy]-2-(4-methoxyphenyl)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]-methyl-methylidene-λ4-sulfane
Also Known As: Ethyl 2,3-Di-O-(4-Methoxybenzy)-4,6-(4-methoxybenzylidene)-beta-D-thiogalactopyranoside, (2R,4aR,6S,7S,8R,8aR)-7,8-bis((4-methoxyphenoxy)methoxy)-2-(4-methoxyphenyl)-6-(methyl(methylene)-lambda4-sulfaneyl)hexahydropyrano[3,2-d][1,3]dioxine, [7,8-bis[(4-methoxyphenoxy)methoxy]-2-(4-methoxyphenyl)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]-methyl-methylidene-
| Molecular Formula | C32H38O10S |
| Molecular Weight | 614.21857 g/mol |
| XLogP | 5.9 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 13 |
| Exact Mass | 614.21857 Da |
| Heavy Atoms | 43 |
| Complexity | 825.0 |
| SMILES | COC1=CC=C(C=C1)C2OCC3C(O2)C(C(C(O3)S(=C)C)OCOC4=CC=C(C=C4)OC)OCOC5=CC=C(C=C5)OC |
| InChIKey | FQVYWXNLIPELAI-UHFFFAOYSA-N |
The XLogP value of 5.9 indicates that Ethyl 2,3-Di-O-(4-Methoxybenzy)-4,6-(4-methoxybenzylidene)-beta-D-thiogalactopyranoside is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2,3-Di-O-(4-Methoxybenzy)-4,6-(4-methoxybenzylidene)-beta-D-thiogalactopyranoside. Following Lipinski's Rule of Five, Ethyl 2,3-Di-O-(4-Methoxybenzy)-4,6-(4-methoxybenzylidene)-beta-D-thiogalactopyranoside has 0 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Ethyl 2,3-Di-O-(4-Methoxybenzy)-4,6-(4-methoxybenzylidene)-beta-D-thiogalactopyranoside is 1041171-02-1.
The molecular formula of Ethyl 2,3-Di-O-(4-Methoxybenzy)-4,6-(4-methoxybenzylidene)-beta-D-thiogalactopyranoside is C32H38O10S.
The molecular weight of Ethyl 2,3-Di-O-(4-Methoxybenzy)-4,6-(4-methoxybenzylidene)-beta-D-thiogalactopyranoside is 614.21857 g/mol.
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