1(6H)-Pyridazinepropanoic acid, 5-cyano-6-oxo-3,4-diphenyl-, 2-methoxyethyl ester
TL;DR: 1(6H)-Pyridazinepropanoic acid, 5-cyano-6-oxo-3,4-diphenyl-, 2-methoxyethyl ester (CAS 82232-79-9) is a chemical compound with molecular formula C23H21N3O4 and molecular weight 403.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxyethyl 3-(5-cyano-6-oxo-3,4-diphenylpyridazin-1-yl)propanoate
Also Known As: 1(6H)-Pyridazinepropanoic acid, 5-cyano-6-oxo-3,4-diphenyl-, 2-methoxyethyl ester, 2-Methoxyethyl 5-cyano-6-oxo-3,4-diphenyl-1(6H)-pyridazinepropanoate, 2-methoxyethyl 3-(5-cyano-6-oxo-3,4-diphenylpyridazin-1(6H)-yl)propanoate, 2-methoxyethyl 3-(5-cyano-6-oxo-3,4-diphenylpyridazin-1-yl)propanoate
| Molecular Formula | C23H21N3O4 |
|---|---|
| Molecular Weight | 403.15 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 92.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 403.1532 |
| Heavy Atoms | 30 |
| Complexity | 737.0 |
Chemical Identifiers
| CAS Number | 82232-79-9 |
|---|---|
| SMILES | COCCOC(=O)CCN1C(=O)C(=C(C(=N1)C2=CC=CC=C2)C3=CC=CC=C3)C#N |
| InChIKey | VWHZKSLDTBZACB-UHFFFAOYSA-N |
Product Overview
1(6H)-Pyridazinepropanoic acid, 5-cyano-6-oxo-3,4-diphenyl-, 2-methoxyethyl ester (CAS 82232-79-9), with molecular formula C23H21N3O4 and molecular weight 403.15 g/mol. IUPAC: 2-methoxyethyl 3-(5-cyano-6-oxo-3,4-diphenylpyridazin-1-yl)propanoate.
Chemical Property Profile of 1(6H)-Pyridazinepropanoic acid, 5-cyano-6-oxo-3,4-diphenyl-, 2-methoxyethyl ester
Property Insights of 1(6H)-Pyridazinepropanoic acid, 5-cyano-6-oxo-3,4-diphenyl-, 2-methoxyethyl ester
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1(6H)-Pyridazinepropanoic acid, 5-cyano-6-oxo-3,4-diphenyl-, 2-methoxyethyl ester. The TPSA of 92.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1(6H)-Pyridazinepropanoic acid, 5-cyano-6-oxo-3,4-diphenyl-, 2-methoxyethyl ester. Following Lipinski's Rule of Five, 1(6H)-Pyridazinepropanoic acid, 5-cyano-6-oxo-3,4-diphenyl-, 2-methoxyethyl ester has 0 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 1(6H)-Pyridazinepropanoic acid, 5-cyano-6-oxo-3,4-diphenyl-, 2-methoxyethyl ester?
The CAS number of 1(6H)-Pyridazinepropanoic acid, 5-cyano-6-oxo-3,4-diphenyl-, 2-methoxyethyl ester is 82232-79-9.
What is the molecular formula of 1(6H)-Pyridazinepropanoic acid, 5-cyano-6-oxo-3,4-diphenyl-, 2-methoxyethyl ester?
The molecular formula of 1(6H)-Pyridazinepropanoic acid, 5-cyano-6-oxo-3,4-diphenyl-, 2-methoxyethyl ester is C23H21N3O4.
What is the molecular weight of 1(6H)-Pyridazinepropanoic acid, 5-cyano-6-oxo-3,4-diphenyl-, 2-methoxyethyl ester?
The molecular weight of 1(6H)-Pyridazinepropanoic acid, 5-cyano-6-oxo-3,4-diphenyl-, 2-methoxyethyl ester is 403.15 g/mol.
Where can I buy 1(6H)-Pyridazinepropanoic acid, 5-cyano-6-oxo-3,4-diphenyl-, 2-methoxyethyl ester?
You can request a quote for 1(6H)-Pyridazinepropanoic acid, 5-cyano-6-oxo-3,4-diphenyl-, 2-methoxyethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1(6H)-Pyridazinepropanoic acid, 5-cyano-6-oxo-3,4-diphenyl-, 2-methoxyethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 1(6H)-Pyridazinepropanoic acid, 5-cyano-6-oxo-3,4-diphenyl-, 2-methoxyethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.