AB00717469-01
TL;DR: AB00717469-01 (CAS 730982-66-8) is a chemical compound with molecular formula C23H19ClN2O5 and molecular weight 438.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-[5-(4-chlorophenyl)-3-(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-oxoethoxy]-3-methoxybenzaldehyde
Also Known As: AB00717469-01, 4-[2-[5-(4-chlorophenyl)-3-(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-oxoethoxy]-3-methoxybenzaldehyde, 4-[2-[3-(4-chlorophenyl)-5-(2-furyl)-4,5-dihydropyrazol-1-yl]-2-oxo-ethoxy]-3-methoxy-benzaldehyde, 4-{2-[3-(4-chlorophenyl)-5-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethoxy}-3-methoxybenzaldehyde
| Molecular Formula | C23H19ClN2O5 |
|---|---|
| Molecular Weight | 438.10 g/mol |
| LogP | 4.5108 |
| Topological Polar Surface Area | 81.34 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 438.09824 |
| Heavy Atoms | 31 |
| Complexity | 1109.5054 |
Chemical Identifiers
| CAS Number | 730982-66-8 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C=O)OCC(=O)N2C(CC(=N2)C3=CC=C(C=C3)Cl)C4=CC=CO4 |
Product Overview
AB00717469-01 (CAS 730982-66-8), with molecular formula C23H19ClN2O5 and molecular weight 438.10 g/mol. IUPAC: 4-[2-[5-(4-chlorophenyl)-3-(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-oxoethoxy]-3-methoxybenzaldehyde.
Chemical Property Profile of AB00717469-01
Property Insights of AB00717469-01
The XLogP value of 4.5108 indicates that AB00717469-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.34 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00717469-01. Following Lipinski's Rule of Five, AB00717469-01 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 AB00717469-01?
The CAS number of AB00717469-01 is 730982-66-8.
What is the molecular formula of AB00717469-01?
The molecular formula of AB00717469-01 is C23H19ClN2O5.
What is the molecular weight of AB00717469-01?
The molecular weight of AB00717469-01 is 438.10 g/mol.
Where can I buy AB00717469-01?
You can request a quote for AB00717469-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00717469-01?
Yes, KEHONG BIO provides custom synthesis services for AB00717469-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.