![methyl 3-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-2-thiophenecarboxylate structure](/static/products/1005/1005552-54-4.webp)
methyl 3-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-2-thiophenecarboxylate
TL;DR: methyl 3-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-2-thiophenecarboxylate (CAS 1005552-54-4) is a chemical compound with molecular formula C11H10BrN3O3S and molecular weight 342.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[(4-bromo-1-methylpyrazole-5-carbonyl)amino]thiophene-2-carboxylate
Also Known As: methyl 3-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-2-thiophenecarboxylate, methyl 3-[(4-bromo-2-methylpyrazole-3-carbonyl)amino]thiophene-2-carboxylate, methyl 3-(4-bromo-1-methyl-1H-pyrazole-5-carboxamido)thiophene-2-carboxylate, Methyl 3-[(4-bromo-2-methyl-pyrazole-3-carbonyl)amino]thiophene-2-carboxylate
| Molecular Formula | C11H10BrN3O3S |
|---|---|
| Molecular Weight | 342.96 g/mol |
| LogP | 2.283 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 342.96262 |
| Heavy Atoms | 19 |
| Complexity | 615.41895 |
Chemical Identifiers
| CAS Number | 1005552-54-4 |
|---|---|
| SMILES | CN1C(=C(C=N1)Br)C(=O)NC2=C(SC=C2)C(=O)OC |
Product Overview
methyl 3-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-2-thiophenecarboxylate (CAS 1005552-54-4), with molecular formula C11H10BrN3O3S and molecular weight 342.96 g/mol. IUPAC: methyl 3-[(4-bromo-1-methylpyrazole-5-carbonyl)amino]thiophene-2-carboxylate.
Chemical Property Profile of methyl 3-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-2-thiophenecarboxylate
Property Insights of methyl 3-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-2-thiophenecarboxylate
The XLogP value of 2.283 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 3-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-2-thiophenecarboxylate. The TPSA of 73.22 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 3-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-2-thiophenecarboxylate. Following Lipinski's Rule of Five, methyl 3-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-2-thiophenecarboxylate 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 methyl 3-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-2-thiophenecarboxylate?
The CAS number of methyl 3-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-2-thiophenecarboxylate is 1005552-54-4.
What is the molecular formula of methyl 3-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-2-thiophenecarboxylate?
The molecular formula of methyl 3-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-2-thiophenecarboxylate is C11H10BrN3O3S.
What is the molecular weight of methyl 3-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-2-thiophenecarboxylate?
The molecular weight of methyl 3-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-2-thiophenecarboxylate is 342.96 g/mol.
Where can I buy methyl 3-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-2-thiophenecarboxylate?
You can request a quote for methyl 3-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-2-thiophenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 3-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-2-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-2-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.