![ethyl 4-{[(1-methyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate structure](/static/products/3118/311812-87-0.webp)
ethyl 4-{[(1-methyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate
TL;DR: ethyl 4-{[(1-methyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate (CAS 311812-87-0) is a chemical compound with molecular formula C14H15N3O3 and molecular weight 273.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(2-methylpyrazole-3-carbonyl)amino]benzoate
Also Known As: ethyl 4-[(2-methylpyrazole-3-carbonyl)amino]benzoate, ethyl 4-{[(1-methyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate, BAS 00239016, ethyl 4-(1-methyl-1H-pyrazole-5-carboxamido)benzoate, ETHYL 4-(1-METHYL-1H-PYRAZOLE-5-AMIDO)BENZOATE
| Molecular Formula | C14H15N3O3 |
|---|---|
| Molecular Weight | 273.11 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 73.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 273.11133 |
| Heavy Atoms | 20 |
| Complexity | 354.0 |
Chemical Identifiers
| CAS Number | 311812-87-0 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=NN2C |
| InChIKey | NTDROUOWRLKCIP-UHFFFAOYSA-N |
Product Overview
ethyl 4-{[(1-methyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate (CAS 311812-87-0), with molecular formula C14H15N3O3 and molecular weight 273.11 g/mol. IUPAC: ethyl 4-[(2-methylpyrazole-3-carbonyl)amino]benzoate.
Chemical Property Profile of ethyl 4-{[(1-methyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate
Property Insights of ethyl 4-{[(1-methyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-{[(1-methyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate. The TPSA of 73.2 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-{[(1-methyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate. Following Lipinski's Rule of Five, ethyl 4-{[(1-methyl-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 ethyl 4-{[(1-methyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate?
The CAS number of ethyl 4-{[(1-methyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate is 311812-87-0.
What is the molecular formula of ethyl 4-{[(1-methyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate?
The molecular formula of ethyl 4-{[(1-methyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate is C14H15N3O3.
What is the molecular weight of ethyl 4-{[(1-methyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate?
The molecular weight of ethyl 4-{[(1-methyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate is 273.11 g/mol.
Where can I buy ethyl 4-{[(1-methyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate?
You can request a quote for ethyl 4-{[(1-methyl-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 ethyl 4-{[(1-methyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-{[(1-methyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.