![[4-(3,4-Dichlorobenzoylamino)-3,5-dimethylpyrazol-1-yl]acetic acid, ethyl ester structure](/static/products/956/956360-89-7.png)
[4-(3,4-Dichlorobenzoylamino)-3,5-dimethylpyrazol-1-yl]acetic acid, ethyl ester
TL;DR: [4-(3,4-Dichlorobenzoylamino)-3,5-dimethylpyrazol-1-yl]acetic acid, ethyl ester (CAS 956360-89-7) is a chemical compound with molecular formula C16H17Cl2N3O3 and molecular weight 369.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[4-[(3,4-dichlorobenzoyl)amino]-3,5-dimethylpyrazol-1-yl]acetate
Also Known As: A3639/0154456, ethyl 2-(4-(3,4-dichlorobenzamido)-3,5-dimethyl-1H-pyrazol-1-yl)acetate, ethyl 2-[4-[(3,4-dichlorobenzoyl)amino]-3,5-dimethylpyrazol-1-yl]acetate, [4-(3,4-Dichlorobenzoylamino)-3,5-dimethylpyrazol-1-yl]acetic acid, ethyl ester, ethyl (4-{[(3,4-dichlorophenyl)carbonyl]amino}-3,5-dimethyl-1H-pyrazol-1-yl)acetate
| Molecular Formula | C16H17Cl2N3O3 |
|---|---|
| Molecular Weight | 369.06 g/mol |
| LogP | 3.62214 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 369.0647 |
| Heavy Atoms | 24 |
| Complexity | 787.1151 |
Chemical Identifiers
| CAS Number | 956360-89-7 |
|---|---|
| SMILES | CCOC(=O)CN1C(=C(C(=N1)C)NC(=O)C2=CC(=C(C=C2)Cl)Cl)C |
Product Overview
[4-(3,4-Dichlorobenzoylamino)-3,5-dimethylpyrazol-1-yl]acetic acid, ethyl ester (CAS 956360-89-7), with molecular formula C16H17Cl2N3O3 and molecular weight 369.06 g/mol. IUPAC: ethyl 2-[4-[(3,4-dichlorobenzoyl)amino]-3,5-dimethylpyrazol-1-yl]acetate.
Chemical Property Profile of [4-(3,4-Dichlorobenzoylamino)-3,5-dimethylpyrazol-1-yl]acetic acid, ethyl ester
Property Insights of [4-(3,4-Dichlorobenzoylamino)-3,5-dimethylpyrazol-1-yl]acetic acid, ethyl ester
The XLogP value of 3.62214 indicates that [4-(3,4-Dichlorobenzoylamino)-3,5-dimethylpyrazol-1-yl]acetic acid, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.22 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-(3,4-Dichlorobenzoylamino)-3,5-dimethylpyrazol-1-yl]acetic acid, ethyl ester. Following Lipinski's Rule of Five, [4-(3,4-Dichlorobenzoylamino)-3,5-dimethylpyrazol-1-yl]acetic acid, ethyl ester has 1 hydrogen bond donor(s) and 4 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 [4-(3,4-Dichlorobenzoylamino)-3,5-dimethylpyrazol-1-yl]acetic acid, ethyl ester?
The CAS number of [4-(3,4-Dichlorobenzoylamino)-3,5-dimethylpyrazol-1-yl]acetic acid, ethyl ester is 956360-89-7.
What is the molecular formula of [4-(3,4-Dichlorobenzoylamino)-3,5-dimethylpyrazol-1-yl]acetic acid, ethyl ester?
The molecular formula of [4-(3,4-Dichlorobenzoylamino)-3,5-dimethylpyrazol-1-yl]acetic acid, ethyl ester is C16H17Cl2N3O3.
What is the molecular weight of [4-(3,4-Dichlorobenzoylamino)-3,5-dimethylpyrazol-1-yl]acetic acid, ethyl ester?
The molecular weight of [4-(3,4-Dichlorobenzoylamino)-3,5-dimethylpyrazol-1-yl]acetic acid, ethyl ester is 369.06 g/mol.
Where can I buy [4-(3,4-Dichlorobenzoylamino)-3,5-dimethylpyrazol-1-yl]acetic acid, ethyl ester?
You can request a quote for [4-(3,4-Dichlorobenzoylamino)-3,5-dimethylpyrazol-1-yl]acetic acid, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-(3,4-Dichlorobenzoylamino)-3,5-dimethylpyrazol-1-yl]acetic acid, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for [4-(3,4-Dichlorobenzoylamino)-3,5-dimethylpyrazol-1-yl]acetic acid, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.