![2-(((3-hydroxy-6-oxo-6H-benzo[c]chromen-4-yl)methyl)amino)-3-methylpentanoic acid structure](/static/products/139/1396963-77-1.png)
2-(((3-hydroxy-6-oxo-6H-benzo[c]chromen-4-yl)methyl)amino)-3-methylpentanoic acid
TL;DR: 2-(((3-hydroxy-6-oxo-6H-benzo[c]chromen-4-yl)methyl)amino)-3-methylpentanoic acid (CAS 1396963-77-1) is a chemical compound with molecular formula C20H21NO5 and molecular weight 355.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-hydroxy-6-oxobenzo[c]chromen-4-yl)methylamino]-3-methylpentanoic acid
Also Known As: 2-(((3-hydroxy-6-oxo-6H-benzo[c]chromen-4-yl)methyl)amino)-3-methylpentanoic acid, 2-[(3-hydroxy-6-oxobenzo[c]chromen-4-yl)methylamino]-3-methylpentanoic acid
| Molecular Formula | C20H21NO5 |
|---|---|
| Molecular Weight | 355.14 g/mol |
| LogP | 3.2407 |
| Topological Polar Surface Area | 99.77 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 355.14197 |
| Heavy Atoms | 26 |
| Complexity | 1023.8012 |
Chemical Identifiers
| CAS Number | 1396963-77-1 |
|---|---|
| SMILES | CCC(C)C(C(=O)O)NCC1=C(C=CC2=C1OC(=O)C3=CC=CC=C23)O |
Product Overview
2-(((3-hydroxy-6-oxo-6H-benzo[c]chromen-4-yl)methyl)amino)-3-methylpentanoic acid (CAS 1396963-77-1), with molecular formula C20H21NO5 and molecular weight 355.14 g/mol. IUPAC: 2-[(3-hydroxy-6-oxobenzo[c]chromen-4-yl)methylamino]-3-methylpentanoic acid.
Chemical Property Profile of 2-(((3-hydroxy-6-oxo-6H-benzo[c]chromen-4-yl)methyl)amino)-3-methylpentanoic acid
Property Insights of 2-(((3-hydroxy-6-oxo-6H-benzo[c]chromen-4-yl)methyl)amino)-3-methylpentanoic acid
The XLogP value of 3.2407 indicates that 2-(((3-hydroxy-6-oxo-6H-benzo[c]chromen-4-yl)methyl)amino)-3-methylpentanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(((3-hydroxy-6-oxo-6H-benzo[c]chromen-4-yl)methyl)amino)-3-methylpentanoic acid. Following Lipinski's Rule of Five, 2-(((3-hydroxy-6-oxo-6H-benzo[c]chromen-4-yl)methyl)amino)-3-methylpentanoic acid has 3 hydrogen bond donor(s) and 5 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 2-(((3-hydroxy-6-oxo-6H-benzo[c]chromen-4-yl)methyl)amino)-3-methylpentanoic acid?
The CAS number of 2-(((3-hydroxy-6-oxo-6H-benzo[c]chromen-4-yl)methyl)amino)-3-methylpentanoic acid is 1396963-77-1.
What is the molecular formula of 2-(((3-hydroxy-6-oxo-6H-benzo[c]chromen-4-yl)methyl)amino)-3-methylpentanoic acid?
The molecular formula of 2-(((3-hydroxy-6-oxo-6H-benzo[c]chromen-4-yl)methyl)amino)-3-methylpentanoic acid is C20H21NO5.
What is the molecular weight of 2-(((3-hydroxy-6-oxo-6H-benzo[c]chromen-4-yl)methyl)amino)-3-methylpentanoic acid?
The molecular weight of 2-(((3-hydroxy-6-oxo-6H-benzo[c]chromen-4-yl)methyl)amino)-3-methylpentanoic acid is 355.14 g/mol.
Where can I buy 2-(((3-hydroxy-6-oxo-6H-benzo[c]chromen-4-yl)methyl)amino)-3-methylpentanoic acid?
You can request a quote for 2-(((3-hydroxy-6-oxo-6H-benzo[c]chromen-4-yl)methyl)amino)-3-methylpentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(((3-hydroxy-6-oxo-6H-benzo[c]chromen-4-yl)methyl)amino)-3-methylpentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(((3-hydroxy-6-oxo-6H-benzo[c]chromen-4-yl)methyl)amino)-3-methylpentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.