[2-(2,6-dichloro-3-methylanilino)-2-oxoethyl] 4-hydroxy-1-phenylpyrazole-3-carboxylate
TL;DR: [2-(2,6-dichloro-3-methylanilino)-2-oxoethyl] 4-hydroxy-1-phenylpyrazole-3-carboxylate (CAS 956185-58-3) is a chemical compound with molecular formula C19H15Cl2N3O4 and molecular weight 419.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2,6-dichloro-3-methylanilino)-2-oxoethyl] 4-hydroxy-1-phenylpyrazole-3-carboxylate
Also Known As: [2-(2,6-dichloro-3-methylanilino)-2-oxoethyl] 4-hydroxy-1-phenylpyrazole-3-carboxylate|(2,6-dichloro-3-methyl-phenyl)carbamoylmethyl 4-hydroxy-1-phenyl-pyrazole-3-carboxylate|2-(2,6-Dichloro-3-methylanilino)-2-oxoethyl 4-hydroxy-1-phenyl-1H-pyrazole-3-carboxylate|MLS002161316|SMR001243739
| Molecular Formula | C19H15Cl2N3O4 |
|---|---|
| Molecular Weight | 419.04 g/mol |
| LogP | 3.98862 |
| Topological Polar Surface Area | 93.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 419.04398 |
| Heavy Atoms | 28 |
| Complexity | 1035.1581 |
Chemical Identifiers
| CAS Number | 956185-58-3 |
|---|---|
| SMILES | CC1=C(C(=C(C=C1)Cl)NC(=O)COC(=O)C2=NN(C=C2O)C3=CC=CC=C3)Cl |
Product Overview
[2-(2,6-dichloro-3-methylanilino)-2-oxoethyl] 4-hydroxy-1-phenylpyrazole-3-carboxylate (CAS 956185-58-3), with molecular formula C19H15Cl2N3O4 and molecular weight 419.04 g/mol. IUPAC: [2-(2,6-dichloro-3-methylanilino)-2-oxoethyl] 4-hydroxy-1-phenylpyrazole-3-carboxylate.
Chemical Property Profile of [2-(2,6-dichloro-3-methylanilino)-2-oxoethyl] 4-hydroxy-1-phenylpyrazole-3-carboxylate
Property Insights of [2-(2,6-dichloro-3-methylanilino)-2-oxoethyl] 4-hydroxy-1-phenylpyrazole-3-carboxylate
The XLogP value of 3.98862 indicates that [2-(2,6-dichloro-3-methylanilino)-2-oxoethyl] 4-hydroxy-1-phenylpyrazole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.45 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(2,6-dichloro-3-methylanilino)-2-oxoethyl] 4-hydroxy-1-phenylpyrazole-3-carboxylate. Following Lipinski's Rule of Five, [2-(2,6-dichloro-3-methylanilino)-2-oxoethyl] 4-hydroxy-1-phenylpyrazole-3-carboxylate 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 [2-(2,6-dichloro-3-methylanilino)-2-oxoethyl] 4-hydroxy-1-phenylpyrazole-3-carboxylate?
The CAS number of [2-(2,6-dichloro-3-methylanilino)-2-oxoethyl] 4-hydroxy-1-phenylpyrazole-3-carboxylate is 956185-58-3.
What is the molecular formula of [2-(2,6-dichloro-3-methylanilino)-2-oxoethyl] 4-hydroxy-1-phenylpyrazole-3-carboxylate?
The molecular formula of [2-(2,6-dichloro-3-methylanilino)-2-oxoethyl] 4-hydroxy-1-phenylpyrazole-3-carboxylate is C19H15Cl2N3O4.
What is the molecular weight of [2-(2,6-dichloro-3-methylanilino)-2-oxoethyl] 4-hydroxy-1-phenylpyrazole-3-carboxylate?
The molecular weight of [2-(2,6-dichloro-3-methylanilino)-2-oxoethyl] 4-hydroxy-1-phenylpyrazole-3-carboxylate is 419.04 g/mol.
Where can I buy [2-(2,6-dichloro-3-methylanilino)-2-oxoethyl] 4-hydroxy-1-phenylpyrazole-3-carboxylate?
You can request a quote for [2-(2,6-dichloro-3-methylanilino)-2-oxoethyl] 4-hydroxy-1-phenylpyrazole-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(2,6-dichloro-3-methylanilino)-2-oxoethyl] 4-hydroxy-1-phenylpyrazole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [2-(2,6-dichloro-3-methylanilino)-2-oxoethyl] 4-hydroxy-1-phenylpyrazole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.