![butyl 4-{[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate structure](/static/products/5151/515149-46-9.webp)
butyl 4-{[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate
TL;DR: butyl 4-{[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate (CAS 515149-46-9) is a chemical compound with molecular formula C17H20ClN3O3 and molecular weight 349.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 4-[(4-chloro-1-ethylpyrazole-5-carbonyl)amino]benzoate
Also Known As: butyl 4-{[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate, butyl 4-[(4-chloro-2-ethylpyrazole-3-carbonyl)amino]benzoate, butyl 4-(4-chloro-1-ethyl-1H-pyrazole-5-carboxamido)benzoate
| Molecular Formula | C17H20ClN3O3 |
|---|---|
| Molecular Weight | 349.12 g/mol |
| LogP | 3.7656 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 349.11932 |
| Heavy Atoms | 24 |
| Complexity | 710.3709 |
Chemical Identifiers
| CAS Number | 515149-46-9 |
|---|---|
| SMILES | CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=NN2CC)Cl |
Product Overview
butyl 4-{[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate (CAS 515149-46-9), with molecular formula C17H20ClN3O3 and molecular weight 349.12 g/mol. IUPAC: butyl 4-[(4-chloro-1-ethylpyrazole-5-carbonyl)amino]benzoate.
Chemical Property Profile of butyl 4-{[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate
Property Insights of butyl 4-{[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate
The XLogP value of 3.7656 indicates that butyl 4-{[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate 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 butyl 4-{[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate. Following Lipinski's Rule of Five, butyl 4-{[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate 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 butyl 4-{[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate?
The CAS number of butyl 4-{[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate is 515149-46-9.
What is the molecular formula of butyl 4-{[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate?
The molecular formula of butyl 4-{[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate is C17H20ClN3O3.
What is the molecular weight of butyl 4-{[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate?
The molecular weight of butyl 4-{[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate is 349.12 g/mol.
Where can I buy butyl 4-{[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate?
You can request a quote for butyl 4-{[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for butyl 4-{[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for butyl 4-{[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.