![octyl 3-hydroxy-2-[[4-oxo-4-(4-sulfamoylanilino)butanoyl]amino]-3-phenylpropanoate structure](/static/products/121/1214710-73-2.png)
octyl 3-hydroxy-2-[[4-oxo-4-(4-sulfamoylanilino)butanoyl]amino]-3-phenylpropanoate
TL;DR: octyl 3-hydroxy-2-[[4-oxo-4-(4-sulfamoylanilino)butanoyl]amino]-3-phenylpropanoate (CAS 1214710-73-2) is a chemical compound with molecular formula C27H37N3O7S and molecular weight 547.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
octyl 3-hydroxy-2-[[4-oxo-4-(4-sulfamoylanilino)butanoyl]amino]-3-phenylpropanoate
Also Known As: octyl 3-hydroxy-2-[[4-oxo-4-(4-sulfamoylanilino)butanoyl]amino]-3-phenylpropanoate, 3-Hydroxy-3-phenyl-2-[3-(4-sulfamoyl-phenylcarbamoyl)-propionylamino]-propionic acid octyl ester, octyl 3-hydroxy-2-(4-oxo-4-((4-sulfamoylphenyl)amino)butanamido)-3-phenylpropanoate, octyl beta-hydroxy-N-{4-oxo-4-[(4-sulfamoylphenyl)amino]butanoyl}phenylalaninate, 2-[[1,4-dioxo-4-(4-sulfamoylanilino)butyl]amino]-3-hydroxy-3-phenylpropanoic acid octyl ester
| Molecular Formula | C27H37N3O7S |
|---|---|
| Molecular Weight | 547.24 g/mol |
| LogP | 3.1748 |
| Topological Polar Surface Area | 164.89 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 16 |
| Exact Mass | 547.2352 |
| Heavy Atoms | 38 |
| Complexity | 1139.021 |
Chemical Identifiers
| CAS Number | 1214710-73-2 |
|---|---|
| SMILES | CCCCCCCCOC(=O)C(C(C1=CC=CC=C1)O)NC(=O)CCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N |
Product Overview
octyl 3-hydroxy-2-[[4-oxo-4-(4-sulfamoylanilino)butanoyl]amino]-3-phenylpropanoate (CAS 1214710-73-2), with molecular formula C27H37N3O7S and molecular weight 547.24 g/mol. IUPAC: octyl 3-hydroxy-2-[[4-oxo-4-(4-sulfamoylanilino)butanoyl]amino]-3-phenylpropanoate.
Chemical Property Profile of octyl 3-hydroxy-2-[[4-oxo-4-(4-sulfamoylanilino)butanoyl]amino]-3-phenylpropanoate
Property Insights of octyl 3-hydroxy-2-[[4-oxo-4-(4-sulfamoylanilino)butanoyl]amino]-3-phenylpropanoate
The XLogP value of 3.1748 indicates that octyl 3-hydroxy-2-[[4-oxo-4-(4-sulfamoylanilino)butanoyl]amino]-3-phenylpropanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 164.89 Ų indicates high polarity, suggesting octyl 3-hydroxy-2-[[4-oxo-4-(4-sulfamoylanilino)butanoyl]amino]-3-phenylpropanoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, octyl 3-hydroxy-2-[[4-oxo-4-(4-sulfamoylanilino)butanoyl]amino]-3-phenylpropanoate has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of octyl 3-hydroxy-2-[[4-oxo-4-(4-sulfamoylanilino)butanoyl]amino]-3-phenylpropanoate?
The CAS number of octyl 3-hydroxy-2-[[4-oxo-4-(4-sulfamoylanilino)butanoyl]amino]-3-phenylpropanoate is 1214710-73-2.
What is the molecular formula of octyl 3-hydroxy-2-[[4-oxo-4-(4-sulfamoylanilino)butanoyl]amino]-3-phenylpropanoate?
The molecular formula of octyl 3-hydroxy-2-[[4-oxo-4-(4-sulfamoylanilino)butanoyl]amino]-3-phenylpropanoate is C27H37N3O7S.
What is the molecular weight of octyl 3-hydroxy-2-[[4-oxo-4-(4-sulfamoylanilino)butanoyl]amino]-3-phenylpropanoate?
The molecular weight of octyl 3-hydroxy-2-[[4-oxo-4-(4-sulfamoylanilino)butanoyl]amino]-3-phenylpropanoate is 547.24 g/mol.
Where can I buy octyl 3-hydroxy-2-[[4-oxo-4-(4-sulfamoylanilino)butanoyl]amino]-3-phenylpropanoate?
You can request a quote for octyl 3-hydroxy-2-[[4-oxo-4-(4-sulfamoylanilino)butanoyl]amino]-3-phenylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for octyl 3-hydroxy-2-[[4-oxo-4-(4-sulfamoylanilino)butanoyl]amino]-3-phenylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for octyl 3-hydroxy-2-[[4-oxo-4-(4-sulfamoylanilino)butanoyl]amino]-3-phenylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.