![Methyl 4-[4-(4-methoxycarbonylphenyl)sulfanyl-3-oxobutyl]sulfanylbenzoate structure](/static/products/6742/67426-07-7.webp)
Methyl 4-[4-(4-methoxycarbonylphenyl)sulfanyl-3-oxobutyl]sulfanylbenzoate
TL;DR: Methyl 4-[4-(4-methoxycarbonylphenyl)sulfanyl-3-oxobutyl]sulfanylbenzoate (CAS 67426-07-7) is a chemical compound with molecular formula C20H20O5S2 and molecular weight 404.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[4-(4-methoxycarbonylphenyl)sulfanyl-3-oxobutyl]sulfanylbenzoate
Also Known As: Dimethyl 4,4'-[(2-oxobutane-1,4-diyl)disulfanediyl]dibenzoate, methyl 4-[4-(4-methoxycarbonylphenyl)sulfanyl-3-oxobutyl]sul, methyl 4-[4-(4-methoxycarbonylphenyl)sulfanyl-3-oxobutyl]sulfanylbenzoate, Dimethyl 4,4'-[(2-oxobutane-1,4-diyl)bis(sulfanediyl)]dibenzoate, METHYL 4-[4-(4-METHOXYCARBONYLPHENYL)SULFANYL-3-OXO-BUTYL]SULFANYLBENZOATE
| Molecular Formula | C20H20O5S2 |
|---|---|
| Molecular Weight | 404.08 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 404.07523 |
| Heavy Atoms | 27 |
| Complexity | 495.0 |
Chemical Identifiers
| CAS Number | 67426-07-7 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)SCCC(=O)CSC2=CC=C(C=C2)C(=O)OC |
| InChIKey | SMVIGSXXAFZAEW-UHFFFAOYSA-N |
Product Overview
Methyl 4-[4-(4-methoxycarbonylphenyl)sulfanyl-3-oxobutyl]sulfanylbenzoate (CAS 67426-07-7), with molecular formula C20H20O5S2 and molecular weight 404.08 g/mol. IUPAC: methyl 4-[4-(4-methoxycarbonylphenyl)sulfanyl-3-oxobutyl]sulfanylbenzoate.
Chemical Property Profile of Methyl 4-[4-(4-methoxycarbonylphenyl)sulfanyl-3-oxobutyl]sulfanylbenzoate
Property Insights of Methyl 4-[4-(4-methoxycarbonylphenyl)sulfanyl-3-oxobutyl]sulfanylbenzoate
The XLogP value of 4.0 indicates that Methyl 4-[4-(4-methoxycarbonylphenyl)sulfanyl-3-oxobutyl]sulfanylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-[4-(4-methoxycarbonylphenyl)sulfanyl-3-oxobutyl]sulfanylbenzoate. Following Lipinski's Rule of Five, Methyl 4-[4-(4-methoxycarbonylphenyl)sulfanyl-3-oxobutyl]sulfanylbenzoate has 0 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 4-[4-(4-methoxycarbonylphenyl)sulfanyl-3-oxobutyl]sulfanylbenzoate?
The CAS number of Methyl 4-[4-(4-methoxycarbonylphenyl)sulfanyl-3-oxobutyl]sulfanylbenzoate is 67426-07-7.
What is the molecular formula of Methyl 4-[4-(4-methoxycarbonylphenyl)sulfanyl-3-oxobutyl]sulfanylbenzoate?
The molecular formula of Methyl 4-[4-(4-methoxycarbonylphenyl)sulfanyl-3-oxobutyl]sulfanylbenzoate is C20H20O5S2.
What is the molecular weight of Methyl 4-[4-(4-methoxycarbonylphenyl)sulfanyl-3-oxobutyl]sulfanylbenzoate?
The molecular weight of Methyl 4-[4-(4-methoxycarbonylphenyl)sulfanyl-3-oxobutyl]sulfanylbenzoate is 404.08 g/mol.
Where can I buy Methyl 4-[4-(4-methoxycarbonylphenyl)sulfanyl-3-oxobutyl]sulfanylbenzoate?
You can request a quote for Methyl 4-[4-(4-methoxycarbonylphenyl)sulfanyl-3-oxobutyl]sulfanylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-[4-(4-methoxycarbonylphenyl)sulfanyl-3-oxobutyl]sulfanylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-[4-(4-methoxycarbonylphenyl)sulfanyl-3-oxobutyl]sulfanylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.