ChemDiv1_003933
TL;DR: ChemDiv1_003933 (CAS 292065-64-6) is a chemical compound with molecular formula C23H15ClN2O6 and molecular weight 450.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[5-[[1-(3-carboxyphenyl)-3-methyl-5-oxopyrazol-4-ylidene]methyl]furan-2-yl]-2-chlorobenzoic acid
Also Known As: ChemDiv1_003933, 5-[5-[[1-(3-carboxyphenyl)-3-methyl-5-oxopyrazol-4-ylidene]methyl]furan-2-yl]-2-chlorobenzoic acid
| Molecular Formula | C23H15ClN2O6 |
|---|---|
| Molecular Weight | 450.06 g/mol |
| LogP | 4.8025 |
| Topological Polar Surface Area | 120.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 450.06186 |
| Heavy Atoms | 32 |
| Complexity | 1337.7595 |
Chemical Identifiers
| CAS Number | 292065-64-6 |
|---|---|
| SMILES | CC1=NN(C(=O)C1=CC2=CC=C(O2)C3=CC(=C(C=C3)Cl)C(=O)O)C4=CC=CC(=C4)C(=O)O |
Product Overview
ChemDiv1_003933 (CAS 292065-64-6), with molecular formula C23H15ClN2O6 and molecular weight 450.06 g/mol. IUPAC: 5-[5-[[1-(3-carboxyphenyl)-3-methyl-5-oxopyrazol-4-ylidene]methyl]furan-2-yl]-2-chlorobenzoic acid.
Chemical Property Profile of ChemDiv1_003933
Property Insights of ChemDiv1_003933
The XLogP value of 4.8025 indicates that ChemDiv1_003933 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.41 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_003933. Following Lipinski's Rule of Five, ChemDiv1_003933 has 2 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 ChemDiv1_003933?
The CAS number of ChemDiv1_003933 is 292065-64-6.
What is the molecular formula of ChemDiv1_003933?
The molecular formula of ChemDiv1_003933 is C23H15ClN2O6.
What is the molecular weight of ChemDiv1_003933?
The molecular weight of ChemDiv1_003933 is 450.06 g/mol.
Where can I buy ChemDiv1_003933?
You can request a quote for ChemDiv1_003933 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_003933?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_003933 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.