GNW6DR95PC
TL;DR: GNW6DR95PC (CAS 82232-19-7) is a chemical compound with molecular formula C23H17Cl2N3O5 and molecular weight 485.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-[3,4-bis(4-chlorophenyl)-5-cyano-6-oxopyridazin-1-yl]ethoxy]-4-oxobutanoic acid
Also Known As: NCI60_003311, Butanedioic acid, mono(2-(3,4-bis(4-chlorophenyl)-5-cyano-6-oxo-1(6H)-pyridazinyl)ethyl) ester, 4-{2-[3,4-bis(4-chlorophenyl)-5-cyano-6-oxopyridazin-1(6h)-yl]ethoxy}-4-oxobutanoic acid, Mono(2-(3,4-bis(4-chlorophenyl)-5-cyano-6-oxo-1(6H)-pyridazinyl)ethyl) butanedioate, 1-[2-[3,4-Bis(4-chlorophenyl)-5-cyano-6-oxo-1(6H)-pyridazinyl]ethyl] butanedioate
| Molecular Formula | C23H17Cl2N3O5 |
|---|---|
| Molecular Weight | 485.05 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 485.05453 |
| Heavy Atoms | 33 |
| Complexity | 878.0 |
Chemical Identifiers
| CAS Number | 82232-19-7 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=C(C(=O)N(N=C2C3=CC=C(C=C3)Cl)CCOC(=O)CCC(=O)O)C#N)Cl |
| InChIKey | AKJTWZYTVPZSDW-UHFFFAOYSA-N |
Product Overview
GNW6DR95PC (CAS 82232-19-7), with molecular formula C23H17Cl2N3O5 and molecular weight 485.05 g/mol. IUPAC: 4-[2-[3,4-bis(4-chlorophenyl)-5-cyano-6-oxopyridazin-1-yl]ethoxy]-4-oxobutanoic acid.
Chemical Property Profile of GNW6DR95PC
Property Insights of GNW6DR95PC
The XLogP value of 3.6 indicates that GNW6DR95PC is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for GNW6DR95PC. Following Lipinski's Rule of Five, GNW6DR95PC has 1 hydrogen bond donor(s) and 7 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 GNW6DR95PC?
The CAS number of GNW6DR95PC is 82232-19-7.
What is the molecular formula of GNW6DR95PC?
The molecular formula of GNW6DR95PC is C23H17Cl2N3O5.
What is the molecular weight of GNW6DR95PC?
The molecular weight of GNW6DR95PC is 485.05 g/mol.
Where can I buy GNW6DR95PC?
You can request a quote for GNW6DR95PC directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for GNW6DR95PC?
Yes, KEHONG BIO provides custom synthesis services for GNW6DR95PC and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.