AH-487/41731956
TL;DR: AH-487/41731956 (CAS 664312-01-0) is a chemical compound with molecular formula C22H20FNO5 and molecular weight 397.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[1-(4-ethoxycarbonyl-3-hydroxyphenyl)-5-(4-fluorophenyl)pyrrol-2-yl]propanoic acid
Also Known As: AH-487/41731956, 3-{1-[4-(ethoxycarbonyl)-3-hydroxyphenyl]-5-(4-fluorophenyl)-1H-pyrrol-2-yl}propanoic acid, 3-[1-(4-ethoxycarbonyl-3-hydroxyphenyl)-5-(4-fluorophenyl)pyrrol-2-yl]propanoic acid, 3-(1-(4-(ethoxycarbonyl)-3-hydroxyphenyl)-5-(4-fluorophenyl)-1H-pyrrol-2-yl)propanoic acid, 3-[1-[4-(ethoxycarbonyl)-3-hydroxyphenyl]-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid
| Molecular Formula | C22H20FNO5 |
|---|---|
| Molecular Weight | 397.13 g/mol |
| LogP | 4.1829 |
| Topological Polar Surface Area | 88.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 397.13254 |
| Heavy Atoms | 29 |
| Complexity | 1039.8562 |
Chemical Identifiers
| CAS Number | 664312-01-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(C=C(C=C1)N2C(=CC=C2C3=CC=C(C=C3)F)CCC(=O)O)O |
Product Overview
AH-487/41731956 (CAS 664312-01-0), with molecular formula C22H20FNO5 and molecular weight 397.13 g/mol. IUPAC: 3-[1-(4-ethoxycarbonyl-3-hydroxyphenyl)-5-(4-fluorophenyl)pyrrol-2-yl]propanoic acid.
Chemical Property Profile of AH-487/41731956
Property Insights of AH-487/41731956
The XLogP value of 4.1829 indicates that AH-487/41731956 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.76 Ų falls within the moderate polarity range, balancing permeability and solubility for AH-487/41731956. Following Lipinski's Rule of Five, AH-487/41731956 has 2 hydrogen bond donor(s) and 4 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 AH-487/41731956?
The CAS number of AH-487/41731956 is 664312-01-0.
What is the molecular formula of AH-487/41731956?
The molecular formula of AH-487/41731956 is C22H20FNO5.
What is the molecular weight of AH-487/41731956?
The molecular weight of AH-487/41731956 is 397.13 g/mol.
Where can I buy AH-487/41731956?
You can request a quote for AH-487/41731956 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AH-487/41731956?
Yes, KEHONG BIO provides custom synthesis services for AH-487/41731956 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.