AB00719673-01
TL;DR: AB00719673-01 (CAS 565175-12-4) is a chemical compound with molecular formula C21H17ClF2N2O4 and molecular weight 434.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 2-chloropyridine-3-carboxylate
Also Known As: AB00719673-01, [2-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 2-chloropyridine-3-carboxylate, 2-{1-[4-(difluoromethoxy)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl}-2-oxoethyl 2-chloropyridine-3-carboxylate
| Molecular Formula | C21H17ClF2N2O4 |
|---|---|
| Molecular Weight | 434.08 g/mol |
| LogP | 4.78364 |
| Topological Polar Surface Area | 70.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 434.0845 |
| Heavy Atoms | 30 |
| Complexity | 1081.1105 |
Chemical Identifiers
| CAS Number | 565175-12-4 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CC=C(C=C2)OC(F)F)C)C(=O)COC(=O)C3=C(N=CC=C3)Cl |
Product Overview
AB00719673-01 (CAS 565175-12-4), with molecular formula C21H17ClF2N2O4 and molecular weight 434.08 g/mol. IUPAC: [2-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 2-chloropyridine-3-carboxylate.
Chemical Property Profile of AB00719673-01
Property Insights of AB00719673-01
The XLogP value of 4.78364 indicates that AB00719673-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.42 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00719673-01. Following Lipinski's Rule of Five, AB00719673-01 has 0 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 AB00719673-01?
The CAS number of AB00719673-01 is 565175-12-4.
What is the molecular formula of AB00719673-01?
The molecular formula of AB00719673-01 is C21H17ClF2N2O4.
What is the molecular weight of AB00719673-01?
The molecular weight of AB00719673-01 is 434.08 g/mol.
Where can I buy AB00719673-01?
You can request a quote for AB00719673-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00719673-01?
Yes, KEHONG BIO provides custom synthesis services for AB00719673-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.