Propyl p-(2-thenoylmercaptopropionylglycyloxy)benzoate
TL;DR: Propyl p-(2-thenoylmercaptopropionylglycyloxy)benzoate (CAS 84856-26-8) is a chemical compound with molecular formula C20H21NO6S2 and molecular weight 435.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 4-[2-[2-(thiophene-2-carbonylsulfanyl)propanoylamino]acetyl]oxybenzoate
Also Known As: Propyl p-(2-thenoylmercaptopropionylglycyloxy)benzoate, propyl 4-[2-[2-(thiophene-2-carbonylsulfanyl)propanoylamino]acetyl]oxybenzoate, Glycine, 4-(1-oxo-2-((2-thienylcarbonyl)thio)propyl)-, 4-(propoxycarbonyl)phenyl ester, N-{2-Oxo-2-[4-(propoxycarbonyl)phenoxy]ethyl}-2-[(thiophene-2-carbonyl)sulfanyl]propanimidic acid, RefChem:346281
| Molecular Formula | C20H21NO6S2 |
|---|---|
| Molecular Weight | 435.08 g/mol |
| LogP | 3.2986 |
| Topological Polar Surface Area | 98.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 435.08102 |
| Heavy Atoms | 29 |
| Complexity | 848.3662 |
Chemical Identifiers
| CAS Number | 84856-26-8 |
|---|---|
| SMILES | CCCOC(=O)C1=CC=C(C=C1)OC(=O)CNC(=O)C(C)SC(=O)C2=CC=CS2 |
Product Overview
Propyl p-(2-thenoylmercaptopropionylglycyloxy)benzoate (CAS 84856-26-8), with molecular formula C20H21NO6S2 and molecular weight 435.08 g/mol. IUPAC: propyl 4-[2-[2-(thiophene-2-carbonylsulfanyl)propanoylamino]acetyl]oxybenzoate.
Chemical Property Profile of Propyl p-(2-thenoylmercaptopropionylglycyloxy)benzoate
Property Insights of Propyl p-(2-thenoylmercaptopropionylglycyloxy)benzoate
The XLogP value of 3.2986 indicates that Propyl p-(2-thenoylmercaptopropionylglycyloxy)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.77 Ų falls within the moderate polarity range, balancing permeability and solubility for Propyl p-(2-thenoylmercaptopropionylglycyloxy)benzoate. Following Lipinski's Rule of Five, Propyl p-(2-thenoylmercaptopropionylglycyloxy)benzoate has 1 hydrogen bond donor(s) and 8 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 Propyl p-(2-thenoylmercaptopropionylglycyloxy)benzoate?
The CAS number of Propyl p-(2-thenoylmercaptopropionylglycyloxy)benzoate is 84856-26-8.
What is the molecular formula of Propyl p-(2-thenoylmercaptopropionylglycyloxy)benzoate?
The molecular formula of Propyl p-(2-thenoylmercaptopropionylglycyloxy)benzoate is C20H21NO6S2.
What is the molecular weight of Propyl p-(2-thenoylmercaptopropionylglycyloxy)benzoate?
The molecular weight of Propyl p-(2-thenoylmercaptopropionylglycyloxy)benzoate is 435.08 g/mol.
Where can I buy Propyl p-(2-thenoylmercaptopropionylglycyloxy)benzoate?
You can request a quote for Propyl p-(2-thenoylmercaptopropionylglycyloxy)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propyl p-(2-thenoylmercaptopropionylglycyloxy)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Propyl p-(2-thenoylmercaptopropionylglycyloxy)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.