![N-(1,3-benzodioxol-5-yl)-1-[(3-chloro-4-fluorophenoxy)methyl]pyrazole-3-carboxamide structure](/static/products/1005/1005605-06-0.webp)
N-(1,3-benzodioxol-5-yl)-1-[(3-chloro-4-fluorophenoxy)methyl]pyrazole-3-carboxamide
TL;DR: N-(1,3-benzodioxol-5-yl)-1-[(3-chloro-4-fluorophenoxy)methyl]pyrazole-3-carboxamide (CAS 1005605-06-0) is a chemical compound with molecular formula C18H13ClFN3O4 and molecular weight 389.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-1-[(3-chloro-4-fluorophenoxy)methyl]pyrazole-3-carboxamide
Also Known As: N-(1,3-benzodioxol-5-yl)-1-[(3-chloro-4-fluorophenoxy)methyl]pyrazole-3-carboxamide, N-(1,3-benzodioxol-5-yl)-1-[(3-chloro-4-fluorophenoxy)methyl]-1H-pyrazole-3-carboxamide, N-benzo[1,3]dioxol-5-yl-1-[(3-chloro-4-fluoro-phenoxy)methyl]pyrazole-3-carboxamide
| Molecular Formula | C18H13ClFN3O4 |
|---|---|
| Molecular Weight | 389.06 g/mol |
| LogP | 3.6931 |
| Topological Polar Surface Area | 74.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 389.05786 |
| Heavy Atoms | 27 |
| Complexity | 1008.02185 |
Chemical Identifiers
| CAS Number | 1005605-06-0 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)NC(=O)C3=NN(C=C3)COC4=CC(=C(C=C4)F)Cl |
Product Overview
N-(1,3-benzodioxol-5-yl)-1-[(3-chloro-4-fluorophenoxy)methyl]pyrazole-3-carboxamide (CAS 1005605-06-0), with molecular formula C18H13ClFN3O4 and molecular weight 389.06 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-1-[(3-chloro-4-fluorophenoxy)methyl]pyrazole-3-carboxamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-yl)-1-[(3-chloro-4-fluorophenoxy)methyl]pyrazole-3-carboxamide
Property Insights of N-(1,3-benzodioxol-5-yl)-1-[(3-chloro-4-fluorophenoxy)methyl]pyrazole-3-carboxamide
The XLogP value of 3.6931 indicates that N-(1,3-benzodioxol-5-yl)-1-[(3-chloro-4-fluorophenoxy)methyl]pyrazole-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.61 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-yl)-1-[(3-chloro-4-fluorophenoxy)methyl]pyrazole-3-carboxamide. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-yl)-1-[(3-chloro-4-fluorophenoxy)methyl]pyrazole-3-carboxamide has 1 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 N-(1,3-benzodioxol-5-yl)-1-[(3-chloro-4-fluorophenoxy)methyl]pyrazole-3-carboxamide?
The CAS number of N-(1,3-benzodioxol-5-yl)-1-[(3-chloro-4-fluorophenoxy)methyl]pyrazole-3-carboxamide is 1005605-06-0.
What is the molecular formula of N-(1,3-benzodioxol-5-yl)-1-[(3-chloro-4-fluorophenoxy)methyl]pyrazole-3-carboxamide?
The molecular formula of N-(1,3-benzodioxol-5-yl)-1-[(3-chloro-4-fluorophenoxy)methyl]pyrazole-3-carboxamide is C18H13ClFN3O4.
What is the molecular weight of N-(1,3-benzodioxol-5-yl)-1-[(3-chloro-4-fluorophenoxy)methyl]pyrazole-3-carboxamide?
The molecular weight of N-(1,3-benzodioxol-5-yl)-1-[(3-chloro-4-fluorophenoxy)methyl]pyrazole-3-carboxamide is 389.06 g/mol.
Where can I buy N-(1,3-benzodioxol-5-yl)-1-[(3-chloro-4-fluorophenoxy)methyl]pyrazole-3-carboxamide?
You can request a quote for N-(1,3-benzodioxol-5-yl)-1-[(3-chloro-4-fluorophenoxy)methyl]pyrazole-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-benzodioxol-5-yl)-1-[(3-chloro-4-fluorophenoxy)methyl]pyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-yl)-1-[(3-chloro-4-fluorophenoxy)methyl]pyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.