methyl 2-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)carbonyl]amino}-4,5-dimethyl-3-thiophenecarboxylate
TL;DR: methyl 2-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)carbonyl]amino}-4,5-dimethyl-3-thiophenecarboxylate (CAS 515874-47-2) is a chemical compound with molecular formula C15H19N3O3S and molecular weight 321.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(1-ethyl-3-methylpyrazole-4-carbonyl)amino]-4,5-dimethylthiophene-3-carboxylate
Also Known As: methyl 2-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)carbonyl]amino}-4,5-dimethyl-3-thiophenecarboxylate, methyl 2-[(1-ethyl-3-methylpyrazole-4-carbonyl)amino]-4,5-dimethylthiophene-3-carboxylate, methyl 2-(1-ethyl-3-methyl-1H-pyrazole-4-carboxamido)-4,5-dimethylthiophene-3-carboxylate
| Molecular Formula | C15H19N3O3S |
|---|---|
| Molecular Weight | 321.11 g/mol |
| LogP | 2.92866 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 321.11472 |
| Heavy Atoms | 22 |
| Complexity | 730.71344 |
Chemical Identifiers
| CAS Number | 515874-47-2 |
|---|---|
| SMILES | CCN1C=C(C(=N1)C)C(=O)NC2=C(C(=C(S2)C)C)C(=O)OC |
Product Overview
methyl 2-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)carbonyl]amino}-4,5-dimethyl-3-thiophenecarboxylate (CAS 515874-47-2), with molecular formula C15H19N3O3S and molecular weight 321.11 g/mol. IUPAC: methyl 2-[(1-ethyl-3-methylpyrazole-4-carbonyl)amino]-4,5-dimethylthiophene-3-carboxylate.
Chemical Property Profile of methyl 2-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)carbonyl]amino}-4,5-dimethyl-3-thiophenecarboxylate
Property Insights of methyl 2-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)carbonyl]amino}-4,5-dimethyl-3-thiophenecarboxylate
The XLogP value of 2.92866 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 2-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)carbonyl]amino}-4,5-dimethyl-3-thiophenecarboxylate. The TPSA of 73.22 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)carbonyl]amino}-4,5-dimethyl-3-thiophenecarboxylate. Following Lipinski's Rule of Five, methyl 2-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)carbonyl]amino}-4,5-dimethyl-3-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 2-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)carbonyl]amino}-4,5-dimethyl-3-thiophenecarboxylate?
The CAS number of methyl 2-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)carbonyl]amino}-4,5-dimethyl-3-thiophenecarboxylate is 515874-47-2.
What is the molecular formula of methyl 2-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)carbonyl]amino}-4,5-dimethyl-3-thiophenecarboxylate?
The molecular formula of methyl 2-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)carbonyl]amino}-4,5-dimethyl-3-thiophenecarboxylate is C15H19N3O3S.
What is the molecular weight of methyl 2-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)carbonyl]amino}-4,5-dimethyl-3-thiophenecarboxylate?
The molecular weight of methyl 2-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)carbonyl]amino}-4,5-dimethyl-3-thiophenecarboxylate is 321.11 g/mol.
Where can I buy methyl 2-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)carbonyl]amino}-4,5-dimethyl-3-thiophenecarboxylate?
You can request a quote for methyl 2-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)carbonyl]amino}-4,5-dimethyl-3-thiophenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)carbonyl]amino}-4,5-dimethyl-3-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)carbonyl]amino}-4,5-dimethyl-3-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.