3-(5-hydroxy-1H-indol-3-yl)-2-(2-((4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl)oxy)propanamido)propanoic acid
TL;DR: 3-(5-hydroxy-1H-indol-3-yl)-2-(2-((4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl)oxy)propanamido)propanoic acid (CAS 1213979-41-9) is a chemical compound with molecular formula C30H26N2O8 and molecular weight 542.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5-hydroxy-1H-indol-3-yl)-2-[2-[4-(4-methoxyphenyl)-2-oxochromen-7-yl]oxypropanoylamino]propanoic acid
Also Known As: 3-(5-hydroxy-1H-indol-3-yl)-2-(2-((4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl)oxy)propanamido)propanoic acid, 5-hydroxy-N-(2-{[4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl]oxy}propanoyl)tryptophan, 3-(5-hydroxy-1H-indol-3-yl)-2-[2-[4-(4-methoxyphenyl)-2-oxochromen-7-yl]oxypropanoylamino]propanoic acid
| Molecular Formula | C30H26N2O8 |
|---|---|
| Molecular Weight | 542.17 g/mol |
| LogP | 4.2349 |
| Topological Polar Surface Area | 151.09 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 542.16895 |
| Heavy Atoms | 40 |
| Complexity | 1770.957 |
Chemical Identifiers
| CAS Number | 1213979-41-9 |
|---|---|
| SMILES | CC(C(=O)NC(CC1=CNC2=C1C=C(C=C2)O)C(=O)O)OC3=CC4=C(C=C3)C(=CC(=O)O4)C5=CC=C(C=C5)OC |
Product Overview
3-(5-hydroxy-1H-indol-3-yl)-2-(2-((4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl)oxy)propanamido)propanoic acid (CAS 1213979-41-9), with molecular formula C30H26N2O8 and molecular weight 542.17 g/mol. IUPAC: 3-(5-hydroxy-1H-indol-3-yl)-2-[2-[4-(4-methoxyphenyl)-2-oxochromen-7-yl]oxypropanoylamino]propanoic acid.
Chemical Property Profile of 3-(5-hydroxy-1H-indol-3-yl)-2-(2-((4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl)oxy)propanamido)propanoic acid
Property Insights of 3-(5-hydroxy-1H-indol-3-yl)-2-(2-((4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl)oxy)propanamido)propanoic acid
The XLogP value of 4.2349 indicates that 3-(5-hydroxy-1H-indol-3-yl)-2-(2-((4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl)oxy)propanamido)propanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 151.09 Ų indicates high polarity, suggesting 3-(5-hydroxy-1H-indol-3-yl)-2-(2-((4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl)oxy)propanamido)propanoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-(5-hydroxy-1H-indol-3-yl)-2-(2-((4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl)oxy)propanamido)propanoic acid 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 3-(5-hydroxy-1H-indol-3-yl)-2-(2-((4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl)oxy)propanamido)propanoic acid?
The CAS number of 3-(5-hydroxy-1H-indol-3-yl)-2-(2-((4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl)oxy)propanamido)propanoic acid is 1213979-41-9.
What is the molecular formula of 3-(5-hydroxy-1H-indol-3-yl)-2-(2-((4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl)oxy)propanamido)propanoic acid?
The molecular formula of 3-(5-hydroxy-1H-indol-3-yl)-2-(2-((4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl)oxy)propanamido)propanoic acid is C30H26N2O8.
What is the molecular weight of 3-(5-hydroxy-1H-indol-3-yl)-2-(2-((4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl)oxy)propanamido)propanoic acid?
The molecular weight of 3-(5-hydroxy-1H-indol-3-yl)-2-(2-((4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl)oxy)propanamido)propanoic acid is 542.17 g/mol.
Where can I buy 3-(5-hydroxy-1H-indol-3-yl)-2-(2-((4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl)oxy)propanamido)propanoic acid?
You can request a quote for 3-(5-hydroxy-1H-indol-3-yl)-2-(2-((4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl)oxy)propanamido)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(5-hydroxy-1H-indol-3-yl)-2-(2-((4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl)oxy)propanamido)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(5-hydroxy-1H-indol-3-yl)-2-(2-((4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl)oxy)propanamido)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.