F1218-0041
TL;DR: F1218-0041 (CAS 882223-90-7) is a chemical compound with molecular formula C18H16ClN3O4 and molecular weight 373.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(4-chlorophenyl)-4-[(Z)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]pyrazol-1-yl]propanoic acid
Also Known As: F1218-0041, 3-[3-(4-chlorophenyl)-4-[(Z)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]pyrazol-1-yl]propanoic acid, (Z)-3-(3-(4-chlorophenyl)-4-(2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl)-1H-pyrazol-1-yl)propanoic acid, 3-[3-(4-chlorophenyl)-4-[(1Z)-2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl]-1H-pyrazol-1-yl]propanoic acid
| Molecular Formula | C18H16ClN3O4 |
|---|---|
| Molecular Weight | 373.08 g/mol |
| LogP | 3.14828 |
| Topological Polar Surface Area | 105.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 373.08295 |
| Heavy Atoms | 26 |
| Complexity | 878.8314 |
Chemical Identifiers
| CAS Number | 882223-90-7 |
|---|---|
| SMILES | CCOC(=O)/C(=C\C1=CN(N=C1C2=CC=C(C=C2)Cl)CCC(=O)O)/C#N |
Product Overview
F1218-0041 (CAS 882223-90-7), with molecular formula C18H16ClN3O4 and molecular weight 373.08 g/mol. IUPAC: 3-[3-(4-chlorophenyl)-4-[(Z)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]pyrazol-1-yl]propanoic acid.
Chemical Property Profile of F1218-0041
Property Insights of F1218-0041
The XLogP value of 3.14828 indicates that F1218-0041 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.21 Ų falls within the moderate polarity range, balancing permeability and solubility for F1218-0041. Following Lipinski's Rule of Five, F1218-0041 has 1 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 F1218-0041?
The CAS number of F1218-0041 is 882223-90-7.
What is the molecular formula of F1218-0041?
The molecular formula of F1218-0041 is C18H16ClN3O4.
What is the molecular weight of F1218-0041?
The molecular weight of F1218-0041 is 373.08 g/mol.
Where can I buy F1218-0041?
You can request a quote for F1218-0041 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1218-0041?
Yes, KEHONG BIO provides custom synthesis services for F1218-0041 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.