RefChem:376121
TL;DR: RefChem:376121 (CAS 22337-23-1) is a chemical compound with molecular formula C19H29Cl2N3O3 and molecular weight 417.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[2-(diethylamino)ethoxy]-3-methyl-1-phenylpyrazole-4-carboxylate;dihydrochloride
Also Known As: Pyrazole-4-carboxylic acid, 5-(2-(diethylamino)ethoxy)-3-methyl-1-phenyl-, ethyl ester, dihydrochloride, 5-(2-(Diethylamino)ethoxy)-3-methyl-1-phenylpyrazole-4-carboxylic acid ethyl ester 2HCl, ethyl 5-[2-(diethylamino)ethoxy]-3-methyl-1-phenyl-1h-pyrazole-4-carboxylate dihydrochloride, ethyl 5-(2-diethylaminoethyloxy)-3-methyl-1-phenylpyrazole-4-carboxylate dihydrochloride, Ethyl 5-(2-(diethylamino)ethoxy)-3-methyl-1-phenyl-1H-pyrazole-4-carboxylate dihydrochloride
| Molecular Formula | C19H29Cl2N3O3 |
|---|---|
| Molecular Weight | 417.16 g/mol |
| LogP | 3.92162 |
| Topological Polar Surface Area | 56.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 417.1586 |
| Heavy Atoms | 27 |
| Complexity | 397.0 |
Chemical Identifiers
| CAS Number | 22337-23-1 |
|---|---|
| SMILES | CCN(CC)CCOC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)OCC.Cl.Cl |
| InChIKey | SKDUQSZSYGSFJS-UHFFFAOYSA-N |
Product Overview
RefChem:376121 (CAS 22337-23-1), with molecular formula C19H29Cl2N3O3 and molecular weight 417.16 g/mol. IUPAC: ethyl 5-[2-(diethylamino)ethoxy]-3-methyl-1-phenylpyrazole-4-carboxylate;dihydrochloride.
Chemical Property Profile of RefChem:376121
Property Insights of RefChem:376121
The XLogP value of 3.92162 indicates that RefChem:376121 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.6 Ų, RefChem:376121 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:376121 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 RefChem:376121?
The CAS number of RefChem:376121 is 22337-23-1.
What is the molecular formula of RefChem:376121?
The molecular formula of RefChem:376121 is C19H29Cl2N3O3.
What is the molecular weight of RefChem:376121?
The molecular weight of RefChem:376121 is 417.16 g/mol.
Where can I buy RefChem:376121?
You can request a quote for RefChem:376121 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:376121?
Yes, KEHONG BIO provides custom synthesis services for RefChem:376121 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.