5C-088
TL;DR: 5C-088 (CAS 338751-15-8) is a chemical compound with molecular formula C20H20ClN3O4 and molecular weight 401.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-4-[(2,4-dimethoxyphenyl)iminomethyl]-5-ethoxy-1H-pyrazol-3-one
Also Known As: 5C-088, 2-(4-chlorophenyl)-4-[(2,4-dimethoxyanilino)methylene]-5-ethoxy-2,4-dihydro-3H-pyrazol-3-one, 2-(4-chlorophenyl)-4-[(2,4-dimethoxyphenyl)iminomethyl]-5-ethoxy-1H-pyrazol-3-one, (4Z)-1-(4-chlorophenyl)-4-{[(2,4-dimethoxyphenyl)amino]methylidene}-3-ethoxy-4,5-dihydro-1H-pyrazol-5-one, (4Z)-2-(4-chlorophenyl)-4-[(2,4-dimethoxyanilino)methylidene]-5-ethoxypyrazol-3-one
| Molecular Formula | C20H20ClN3O4 |
|---|---|
| Molecular Weight | 401.11 g/mol |
| LogP | 3.9855 |
| Topological Polar Surface Area | 77.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 401.11423 |
| Heavy Atoms | 28 |
| Complexity | 1038.5946 |
Chemical Identifiers
| CAS Number | 338751-15-8 |
|---|---|
| SMILES | CCOC1=C(C(=O)N(N1)C2=CC=C(C=C2)Cl)C=NC3=C(C=C(C=C3)OC)OC |
Product Overview
5C-088 (CAS 338751-15-8), with molecular formula C20H20ClN3O4 and molecular weight 401.11 g/mol. IUPAC: 2-(4-chlorophenyl)-4-[(2,4-dimethoxyphenyl)iminomethyl]-5-ethoxy-1H-pyrazol-3-one.
Chemical Property Profile of 5C-088
Property Insights of 5C-088
The XLogP value of 3.9855 indicates that 5C-088 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 5C-088. Following Lipinski's Rule of Five, 5C-088 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 5C-088?
The CAS number of 5C-088 is 338751-15-8.
What is the molecular formula of 5C-088?
The molecular formula of 5C-088 is C20H20ClN3O4.
What is the molecular weight of 5C-088?
The molecular weight of 5C-088 is 401.11 g/mol.
Where can I buy 5C-088?
You can request a quote for 5C-088 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5C-088?
Yes, KEHONG BIO provides custom synthesis services for 5C-088 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.