RefChem:505808
TL;DR: RefChem:505808 (CAS 61550-76-3) is a chemical compound with molecular formula C18H17ClN4O3 and molecular weight 372.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-chloro-2,5-dimethoxyphenyl)diazenyl]-5-methyl-2-phenyl-4H-pyrazol-3-one
Also Known As: 4-((4-Chloro-2,5-dimethoxyphenyl)azo)-2,4-dihydro-5-methyl-2-phenyl-3H-pyrazol-3-one, 4-[(4-Chloro-2,5-dimethoxyphenyl)azo]-2,4-dihydro-5-methyl-2-phenyl-3H-pyrazol-3-one, 4-((4-Chloro-2,5-dimethoxyphenyl)azo)-3-methyl-1-phenyl-5-oxo-1H-pyrazole, 3H-Pyrazol-3-one, 4-((4-chloro-2,5-dimethoxyphenyl)azo)-2,4-dihydro-5-methyl-2-phenyl-, 3H-Pyrazol-3-one, 4-[(4-chloro-2,5-dimethoxyphenyl)azo]-2,4-dihydro-5-methyl-2-phenyl-
| Molecular Formula | C18H17ClN4O3 |
|---|---|
| Molecular Weight | 372.10 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 75.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 372.0989 |
| Heavy Atoms | 26 |
| Complexity | 565.0 |
Chemical Identifiers
| CAS Number | 61550-76-3 |
|---|---|
| SMILES | CC1=NN(C(=O)C1N=NC2=CC(=C(C=C2OC)Cl)OC)C3=CC=CC=C3 |
| InChIKey | KROVXDRIZCELEG-UHFFFAOYSA-N |
Product Overview
RefChem:505808 (CAS 61550-76-3), with molecular formula C18H17ClN4O3 and molecular weight 372.10 g/mol. IUPAC: 4-[(4-chloro-2,5-dimethoxyphenyl)diazenyl]-5-methyl-2-phenyl-4H-pyrazol-3-one.
Chemical Property Profile of RefChem:505808
Property Insights of RefChem:505808
The XLogP value of 3.9 indicates that RefChem:505808 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.9 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:505808. Following Lipinski's Rule of Five, RefChem:505808 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 RefChem:505808?
The CAS number of RefChem:505808 is 61550-76-3.
What is the molecular formula of RefChem:505808?
The molecular formula of RefChem:505808 is C18H17ClN4O3.
What is the molecular weight of RefChem:505808?
The molecular weight of RefChem:505808 is 372.10 g/mol.
Where can I buy RefChem:505808?
You can request a quote for RefChem:505808 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:505808?
Yes, KEHONG BIO provides custom synthesis services for RefChem:505808 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.