3-(5-hydroxy-1H-indol-3-yl)-2-(2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid
TL;DR: 3-(5-hydroxy-1H-indol-3-yl)-2-(2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid (CAS 1214670-89-9) is a chemical compound with molecular formula C24H22N2O7 and molecular weight 450.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-(5-hydroxy-4,7-dimethyl-2-oxochromen-3-yl)acetyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid
Also Known As: 3-(5-hydroxy-1H-indol-3-yl)-2-(2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid, 5-hydroxy-N-[(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetyl]tryptophan, 2-[[2-(5-hydroxy-4,7-dimethyl-2-oxochromen-3-yl)acetyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid
| Molecular Formula | C24H22N2O7 |
|---|---|
| Molecular Weight | 450.14 g/mol |
| LogP | 2.65694 |
| Topological Polar Surface Area | 152.86 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 450.1427 |
| Heavy Atoms | 33 |
| Complexity | 1465.4675 |
Chemical Identifiers
| CAS Number | 1214670-89-9 |
|---|---|
| SMILES | CC1=CC(=C2C(=C(C(=O)OC2=C1)CC(=O)NC(CC3=CNC4=C3C=C(C=C4)O)C(=O)O)C)O |
Product Overview
3-(5-hydroxy-1H-indol-3-yl)-2-(2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid (CAS 1214670-89-9), with molecular formula C24H22N2O7 and molecular weight 450.14 g/mol. IUPAC: 2-[[2-(5-hydroxy-4,7-dimethyl-2-oxochromen-3-yl)acetyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid.
Chemical Property Profile of 3-(5-hydroxy-1H-indol-3-yl)-2-(2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid
Property Insights of 3-(5-hydroxy-1H-indol-3-yl)-2-(2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid
The XLogP value of 2.65694 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5-hydroxy-1H-indol-3-yl)-2-(2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid. The TPSA of 152.86 Ų indicates high polarity, suggesting 3-(5-hydroxy-1H-indol-3-yl)-2-(2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)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-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid has 5 hydrogen bond donor(s) and 6 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 3-(5-hydroxy-1H-indol-3-yl)-2-(2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid?
The CAS number of 3-(5-hydroxy-1H-indol-3-yl)-2-(2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid is 1214670-89-9.
What is the molecular formula of 3-(5-hydroxy-1H-indol-3-yl)-2-(2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid?
The molecular formula of 3-(5-hydroxy-1H-indol-3-yl)-2-(2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid is C24H22N2O7.
What is the molecular weight of 3-(5-hydroxy-1H-indol-3-yl)-2-(2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid?
The molecular weight of 3-(5-hydroxy-1H-indol-3-yl)-2-(2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid is 450.14 g/mol.
Where can I buy 3-(5-hydroxy-1H-indol-3-yl)-2-(2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid?
You can request a quote for 3-(5-hydroxy-1H-indol-3-yl)-2-(2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)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-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(5-hydroxy-1H-indol-3-yl)-2-(2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.