methyl 2-((2-(4-methoxyphenyl)-1-oxo-3-(3-pyridyl)-4-2,3,4-trihydroisoquinolyl)carbonylamino)acetate
TL;DR: methyl 2-((2-(4-methoxyphenyl)-1-oxo-3-(3-pyridyl)-4-2,3,4-trihydroisoquinolyl)carbonylamino)acetate (CAS 1024154-11-7) is a chemical compound with molecular formula C25H23N3O5 and molecular weight 445.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[2-(4-methoxyphenyl)-1-oxo-3-pyridin-3-yl-3,4-dihydroisoquinoline-4-carbonyl]amino]acetate
Also Known As: methyl 2-((2-(4-methoxyphenyl)-1-oxo-3-(3-pyridyl)-4-2,3,4-trihydroisoquinolyl)carbonylamino)acetate, methyl 2-[[2-(4-methoxyphenyl)-1-oxo-3-pyridin-3-yl-3,4-dihydroisoquinoline-4-carbonyl]amino]acetate, methyl 2-[[2-(4-methoxyphenyl)-1-oxo-3-(3-pyridyl)-3,4-dihydroisoquinoline-4-carbonyl]amino]acetate, methyl 2-{[2-(4-methoxyphenyl)-1-oxo-3-(pyridin-3-yl)-1,2,3,4-tetrahydroisoquinolin-4-yl]formamido}acetate
| Molecular Formula | C25H23N3O5 |
|---|---|
| Molecular Weight | 445.16 g/mol |
| LogP | 2.8647 |
| Topological Polar Surface Area | 97.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 445.16376 |
| Heavy Atoms | 33 |
| Complexity | 1164.1746 |
Chemical Identifiers
| CAS Number | 1024154-11-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(C(C3=CC=CC=C3C2=O)C(=O)NCC(=O)OC)C4=CN=CC=C4 |
Product Overview
methyl 2-((2-(4-methoxyphenyl)-1-oxo-3-(3-pyridyl)-4-2,3,4-trihydroisoquinolyl)carbonylamino)acetate (CAS 1024154-11-7), with molecular formula C25H23N3O5 and molecular weight 445.16 g/mol. IUPAC: methyl 2-[[2-(4-methoxyphenyl)-1-oxo-3-pyridin-3-yl-3,4-dihydroisoquinoline-4-carbonyl]amino]acetate.
Chemical Property Profile of methyl 2-((2-(4-methoxyphenyl)-1-oxo-3-(3-pyridyl)-4-2,3,4-trihydroisoquinolyl)carbonylamino)acetate
Property Insights of methyl 2-((2-(4-methoxyphenyl)-1-oxo-3-(3-pyridyl)-4-2,3,4-trihydroisoquinolyl)carbonylamino)acetate
The XLogP value of 2.8647 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 2-((2-(4-methoxyphenyl)-1-oxo-3-(3-pyridyl)-4-2,3,4-trihydroisoquinolyl)carbonylamino)acetate. The TPSA of 97.83 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-((2-(4-methoxyphenyl)-1-oxo-3-(3-pyridyl)-4-2,3,4-trihydroisoquinolyl)carbonylamino)acetate. Following Lipinski's Rule of Five, methyl 2-((2-(4-methoxyphenyl)-1-oxo-3-(3-pyridyl)-4-2,3,4-trihydroisoquinolyl)carbonylamino)acetate has 1 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 methyl 2-((2-(4-methoxyphenyl)-1-oxo-3-(3-pyridyl)-4-2,3,4-trihydroisoquinolyl)carbonylamino)acetate?
The CAS number of methyl 2-((2-(4-methoxyphenyl)-1-oxo-3-(3-pyridyl)-4-2,3,4-trihydroisoquinolyl)carbonylamino)acetate is 1024154-11-7.
What is the molecular formula of methyl 2-((2-(4-methoxyphenyl)-1-oxo-3-(3-pyridyl)-4-2,3,4-trihydroisoquinolyl)carbonylamino)acetate?
The molecular formula of methyl 2-((2-(4-methoxyphenyl)-1-oxo-3-(3-pyridyl)-4-2,3,4-trihydroisoquinolyl)carbonylamino)acetate is C25H23N3O5.
What is the molecular weight of methyl 2-((2-(4-methoxyphenyl)-1-oxo-3-(3-pyridyl)-4-2,3,4-trihydroisoquinolyl)carbonylamino)acetate?
The molecular weight of methyl 2-((2-(4-methoxyphenyl)-1-oxo-3-(3-pyridyl)-4-2,3,4-trihydroisoquinolyl)carbonylamino)acetate is 445.16 g/mol.
Where can I buy methyl 2-((2-(4-methoxyphenyl)-1-oxo-3-(3-pyridyl)-4-2,3,4-trihydroisoquinolyl)carbonylamino)acetate?
You can request a quote for methyl 2-((2-(4-methoxyphenyl)-1-oxo-3-(3-pyridyl)-4-2,3,4-trihydroisoquinolyl)carbonylamino)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2-((2-(4-methoxyphenyl)-1-oxo-3-(3-pyridyl)-4-2,3,4-trihydroisoquinolyl)carbonylamino)acetate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-((2-(4-methoxyphenyl)-1-oxo-3-(3-pyridyl)-4-2,3,4-trihydroisoquinolyl)carbonylamino)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.