![methyl 2-{[(4-iodo-1-methyl-1H-pyrazol-3-yl)carbonyl]amino}-4,5-dimethoxybenzoate structure](/static/products/5151/515121-05-8.webp)
methyl 2-{[(4-iodo-1-methyl-1H-pyrazol-3-yl)carbonyl]amino}-4,5-dimethoxybenzoate
TL;DR: methyl 2-{[(4-iodo-1-methyl-1H-pyrazol-3-yl)carbonyl]amino}-4,5-dimethoxybenzoate (CAS 515121-05-8) is a chemical compound with molecular formula C15H16IN3O5 and molecular weight 445.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(4-iodo-1-methylpyrazole-3-carbonyl)amino]-4,5-dimethoxybenzoate
Also Known As: methyl 2-{[(4-iodo-1-methyl-1H-pyrazol-3-yl)carbonyl]amino}-4,5-dimethoxybenzoate, methyl 2-[(4-iodo-1-methylpyrazole-3-carbonyl)amino]-4,5-dimethoxybenzoate, methyl 2-(4-iodo-1-methyl-1H-pyrazole-3-carboxamido)-4,5-dimethoxybenzoate, Methyl 2-[(4-iodo-1-methyl-pyrazole-3-carbonyl)amino]-4,5-dimethoxy-benzoate
| Molecular Formula | C15H16IN3O5 |
|---|---|
| Molecular Weight | 445.01 g/mol |
| LogP | 2.0808 |
| Topological Polar Surface Area | 91.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 445.01346 |
| Heavy Atoms | 24 |
| Complexity | 787.657 |
Chemical Identifiers
| CAS Number | 515121-05-8 |
|---|---|
| SMILES | CN1C=C(C(=N1)C(=O)NC2=CC(=C(C=C2C(=O)OC)OC)OC)I |
Product Overview
methyl 2-{[(4-iodo-1-methyl-1H-pyrazol-3-yl)carbonyl]amino}-4,5-dimethoxybenzoate (CAS 515121-05-8), with molecular formula C15H16IN3O5 and molecular weight 445.01 g/mol. IUPAC: methyl 2-[(4-iodo-1-methylpyrazole-3-carbonyl)amino]-4,5-dimethoxybenzoate.
Chemical Property Profile of methyl 2-{[(4-iodo-1-methyl-1H-pyrazol-3-yl)carbonyl]amino}-4,5-dimethoxybenzoate
Property Insights of methyl 2-{[(4-iodo-1-methyl-1H-pyrazol-3-yl)carbonyl]amino}-4,5-dimethoxybenzoate
The XLogP value of 2.0808 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 2-{[(4-iodo-1-methyl-1H-pyrazol-3-yl)carbonyl]amino}-4,5-dimethoxybenzoate. The TPSA of 91.68 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-{[(4-iodo-1-methyl-1H-pyrazol-3-yl)carbonyl]amino}-4,5-dimethoxybenzoate. Following Lipinski's Rule of Five, methyl 2-{[(4-iodo-1-methyl-1H-pyrazol-3-yl)carbonyl]amino}-4,5-dimethoxybenzoate has 1 hydrogen bond donor(s) and 6 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 methyl 2-{[(4-iodo-1-methyl-1H-pyrazol-3-yl)carbonyl]amino}-4,5-dimethoxybenzoate?
The CAS number of methyl 2-{[(4-iodo-1-methyl-1H-pyrazol-3-yl)carbonyl]amino}-4,5-dimethoxybenzoate is 515121-05-8.
What is the molecular formula of methyl 2-{[(4-iodo-1-methyl-1H-pyrazol-3-yl)carbonyl]amino}-4,5-dimethoxybenzoate?
The molecular formula of methyl 2-{[(4-iodo-1-methyl-1H-pyrazol-3-yl)carbonyl]amino}-4,5-dimethoxybenzoate is C15H16IN3O5.
What is the molecular weight of methyl 2-{[(4-iodo-1-methyl-1H-pyrazol-3-yl)carbonyl]amino}-4,5-dimethoxybenzoate?
The molecular weight of methyl 2-{[(4-iodo-1-methyl-1H-pyrazol-3-yl)carbonyl]amino}-4,5-dimethoxybenzoate is 445.01 g/mol.
Where can I buy methyl 2-{[(4-iodo-1-methyl-1H-pyrazol-3-yl)carbonyl]amino}-4,5-dimethoxybenzoate?
You can request a quote for methyl 2-{[(4-iodo-1-methyl-1H-pyrazol-3-yl)carbonyl]amino}-4,5-dimethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2-{[(4-iodo-1-methyl-1H-pyrazol-3-yl)carbonyl]amino}-4,5-dimethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-{[(4-iodo-1-methyl-1H-pyrazol-3-yl)carbonyl]amino}-4,5-dimethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.