3-(1-(2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl)piperidine-4-carboxamido)propanoic acid
TL;DR: 3-(1-(2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl)piperidine-4-carboxamido)propanoic acid (CAS 864762-75-4) is a chemical compound with molecular formula C21H23ClN2O7 and molecular weight 450.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[1-[2-(6-chloro-7-hydroxy-4-methyl-2-oxochromen-3-yl)acetyl]piperidine-4-carbonyl]amino]propanoic acid
Also Known As: 3-(1-(2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl)piperidine-4-carboxamido)propanoic acid, 3-[[1-[2-(6-chloro-7-hydroxy-4-methyl-2-oxochromen-3-yl)acetyl]piperidine-4-carbonyl]amino]propanoic acid, N-({1-[(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]piperidin-4-yl}carbonyl)-beta-alanine
| Molecular Formula | C21H23ClN2O7 |
|---|---|
| Molecular Weight | 450.12 g/mol |
| LogP | 1.83242 |
| Topological Polar Surface Area | 137.15 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 450.1194 |
| Heavy Atoms | 31 |
| Complexity | 1087.3053 |
Chemical Identifiers
| CAS Number | 864762-75-4 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)O)CC(=O)N3CCC(CC3)C(=O)NCCC(=O)O |
Product Overview
3-(1-(2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl)piperidine-4-carboxamido)propanoic acid (CAS 864762-75-4), with molecular formula C21H23ClN2O7 and molecular weight 450.12 g/mol. IUPAC: 3-[[1-[2-(6-chloro-7-hydroxy-4-methyl-2-oxochromen-3-yl)acetyl]piperidine-4-carbonyl]amino]propanoic acid.
Chemical Property Profile of 3-(1-(2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl)piperidine-4-carboxamido)propanoic acid
Property Insights of 3-(1-(2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl)piperidine-4-carboxamido)propanoic acid
The XLogP value of 1.83242 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1-(2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl)piperidine-4-carboxamido)propanoic acid. The TPSA of 137.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1-(2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl)piperidine-4-carboxamido)propanoic acid. Following Lipinski's Rule of Five, 3-(1-(2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl)piperidine-4-carboxamido)propanoic acid has 3 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-(1-(2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl)piperidine-4-carboxamido)propanoic acid?
The CAS number of 3-(1-(2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl)piperidine-4-carboxamido)propanoic acid is 864762-75-4.
What is the molecular formula of 3-(1-(2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl)piperidine-4-carboxamido)propanoic acid?
The molecular formula of 3-(1-(2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl)piperidine-4-carboxamido)propanoic acid is C21H23ClN2O7.
What is the molecular weight of 3-(1-(2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl)piperidine-4-carboxamido)propanoic acid?
The molecular weight of 3-(1-(2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl)piperidine-4-carboxamido)propanoic acid is 450.12 g/mol.
Where can I buy 3-(1-(2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl)piperidine-4-carboxamido)propanoic acid?
You can request a quote for 3-(1-(2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl)piperidine-4-carboxamido)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-(1-(2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl)piperidine-4-carboxamido)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(1-(2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl)piperidine-4-carboxamido)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.