methyl 5-(3,4-dichlorophenyl)-1-(2,3-dimethylphenyl)-1H-pyrazole-3-carboxylate
TL;DR: methyl 5-(3,4-dichlorophenyl)-1-(2,3-dimethylphenyl)-1H-pyrazole-3-carboxylate (CAS 4708-23-0) is a chemical compound with molecular formula C19H16Cl2N2O2 and molecular weight 374.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-(3,4-dichlorophenyl)-1-(2,3-dimethylphenyl)pyrazole-3-carboxylate
Also Known As: N-propionyl-holothin, Bionet1_003001, methyl 5-(3,4-dichlorophenyl)-1-(2,3-dimethylphenyl)-1H-pyrazole-3-carboxylate, 4N-546S, methyl 5-(3,4-dichlorophenyl)-1-(2,3-dimethylphenyl)pyrazole-3-carboxylate
| Molecular Formula | C19H16Cl2N2O2 |
|---|---|
| Molecular Weight | 374.06 g/mol |
| LogP | 5.24954 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 374.05887 |
| Heavy Atoms | 25 |
| Complexity | 964.0531 |
Chemical Identifiers
| CAS Number | 4708-23-0 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)N2C(=CC(=N2)C(=O)OC)C3=CC(=C(C=C3)Cl)Cl)C |
Product Overview
methyl 5-(3,4-dichlorophenyl)-1-(2,3-dimethylphenyl)-1H-pyrazole-3-carboxylate (CAS 4708-23-0), with molecular formula C19H16Cl2N2O2 and molecular weight 374.06 g/mol. IUPAC: methyl 5-(3,4-dichlorophenyl)-1-(2,3-dimethylphenyl)pyrazole-3-carboxylate.
Chemical Property Profile of methyl 5-(3,4-dichlorophenyl)-1-(2,3-dimethylphenyl)-1H-pyrazole-3-carboxylate
Property Insights of methyl 5-(3,4-dichlorophenyl)-1-(2,3-dimethylphenyl)-1H-pyrazole-3-carboxylate
The XLogP value of 5.24954 indicates that methyl 5-(3,4-dichlorophenyl)-1-(2,3-dimethylphenyl)-1H-pyrazole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.12 Ų, methyl 5-(3,4-dichlorophenyl)-1-(2,3-dimethylphenyl)-1H-pyrazole-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 5-(3,4-dichlorophenyl)-1-(2,3-dimethylphenyl)-1H-pyrazole-3-carboxylate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 5-(3,4-dichlorophenyl)-1-(2,3-dimethylphenyl)-1H-pyrazole-3-carboxylate?
The CAS number of methyl 5-(3,4-dichlorophenyl)-1-(2,3-dimethylphenyl)-1H-pyrazole-3-carboxylate is 4708-23-0.
What is the molecular formula of methyl 5-(3,4-dichlorophenyl)-1-(2,3-dimethylphenyl)-1H-pyrazole-3-carboxylate?
The molecular formula of methyl 5-(3,4-dichlorophenyl)-1-(2,3-dimethylphenyl)-1H-pyrazole-3-carboxylate is C19H16Cl2N2O2.
What is the molecular weight of methyl 5-(3,4-dichlorophenyl)-1-(2,3-dimethylphenyl)-1H-pyrazole-3-carboxylate?
The molecular weight of methyl 5-(3,4-dichlorophenyl)-1-(2,3-dimethylphenyl)-1H-pyrazole-3-carboxylate is 374.06 g/mol.
Where can I buy methyl 5-(3,4-dichlorophenyl)-1-(2,3-dimethylphenyl)-1H-pyrazole-3-carboxylate?
You can request a quote for methyl 5-(3,4-dichlorophenyl)-1-(2,3-dimethylphenyl)-1H-pyrazole-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 5-(3,4-dichlorophenyl)-1-(2,3-dimethylphenyl)-1H-pyrazole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 5-(3,4-dichlorophenyl)-1-(2,3-dimethylphenyl)-1H-pyrazole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.