Phenyl1-Thio-beta-lactoside
TL;DR: Phenyl1-Thio-beta-lactoside (CAS 84001-70-7) is a chemical compound with molecular formula C18H26O10S and molecular weight 434.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4,5-dihydroxy-2-(hydroxymethyl)-6-phenylsulfanyloxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: Phenyl1-Thio-beta-lactoside, phenyl 4-o-hexopyranosyl-1-thiohexopyranoside, 2-[4,5-dihydroxy-2-(hydroxymethyl)-6-phenylsulfanyloxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol, PHENYL 4-O-.BETA.-D-GALACTOPYRANOSYL-1-THIO-.BETA.-D-GLUCOPYRANOSIDE
| Molecular Formula | C18H26O10S |
|---|---|
| Molecular Weight | 434.12 g/mol |
| LogP | -1.8 |
| Topological Polar Surface Area | 195.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 434.12466 |
| Heavy Atoms | 29 |
| Complexity | 507.0 |
Chemical Identifiers
| CAS Number | 84001-70-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)SC2C(C(C(C(O2)CO)OC3C(C(C(C(O3)CO)O)O)O)O)O |
| InChIKey | FGJLUHTXBRGPSV-UHFFFAOYSA-N |
Product Overview
Phenyl1-Thio-beta-lactoside (CAS 84001-70-7), with molecular formula C18H26O10S and molecular weight 434.12 g/mol. IUPAC: 2-[4,5-dihydroxy-2-(hydroxymethyl)-6-phenylsulfanyloxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol.
Chemical Property Profile of Phenyl1-Thio-beta-lactoside
Property Insights of Phenyl1-Thio-beta-lactoside
The XLogP value of -1.8 indicates that Phenyl1-Thio-beta-lactoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 195.0 Ų indicates high polarity, suggesting Phenyl1-Thio-beta-lactoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Phenyl1-Thio-beta-lactoside has 7 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phenyl1-Thio-beta-lactoside?
The CAS number of Phenyl1-Thio-beta-lactoside is 84001-70-7.
What is the molecular formula of Phenyl1-Thio-beta-lactoside?
The molecular formula of Phenyl1-Thio-beta-lactoside is C18H26O10S.
What is the molecular weight of Phenyl1-Thio-beta-lactoside?
The molecular weight of Phenyl1-Thio-beta-lactoside is 434.12 g/mol.
Where can I buy Phenyl1-Thio-beta-lactoside?
You can request a quote for Phenyl1-Thio-beta-lactoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl1-Thio-beta-lactoside?
Yes, KEHONG BIO provides custom synthesis services for Phenyl1-Thio-beta-lactoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.