![methyl 5-[(4-methoxyanilino)carbonyl]-4-methyl-2-[(2-methyl-3-furoyl)amino]thiophene-3-carboxylate structure](/static/products/4450/445013-88-7.webp)
methyl 5-[(4-methoxyanilino)carbonyl]-4-methyl-2-[(2-methyl-3-furoyl)amino]thiophene-3-carboxylate
TL;DR: methyl 5-[(4-methoxyanilino)carbonyl]-4-methyl-2-[(2-methyl-3-furoyl)amino]thiophene-3-carboxylate (CAS 445013-88-7) is a chemical compound with molecular formula C21H20N2O6S and molecular weight 428.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[(4-methoxyphenyl)carbamoyl]-4-methyl-2-[(2-methylfuran-3-carbonyl)amino]thiophene-3-carboxylate
Also Known As: methyl 5-[(4-methoxyanilino)carbonyl]-4-methyl-2-[(2-methyl-3-furoyl)amino]thiophene-3-carboxylate, methyl 5-[(4-methoxyphenyl)carbamoyl]-4-methyl-2-[(2-methylfuran-3-carbonyl)amino]thiophene-3-carboxylate, methyl 5-((4-methoxyphenyl)carbamoyl)-4-methyl-2-(2-methylfuran-3-carboxamido)thiophene-3-carboxylate, METHYL 5-[(4-METHOXYANILINO)CARBONYL]-4-METHYL-2-{[(2-METHYL-3-FURYL)CARBONYL]AMINO}-3-THIOPHENECARBOXYLATE, methyl 5-[(4-methoxyphenyl)carbamoyl]-4-methyl-2-{[(2-methylfuran-3-yl)carbonyl]amino}thiophene-3-carboxylate
| Molecular Formula | C21H20N2O6S |
|---|---|
| Molecular Weight | 428.10 g/mol |
| LogP | 4.25774 |
| Topological Polar Surface Area | 106.87 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 428.10422 |
| Heavy Atoms | 30 |
| Complexity | 1097.4021 |
Chemical Identifiers
| CAS Number | 445013-88-7 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC)NC(=O)C2=C(OC=C2)C)C(=O)NC3=CC=C(C=C3)OC |
Product Overview
methyl 5-[(4-methoxyanilino)carbonyl]-4-methyl-2-[(2-methyl-3-furoyl)amino]thiophene-3-carboxylate (CAS 445013-88-7), with molecular formula C21H20N2O6S and molecular weight 428.10 g/mol. IUPAC: methyl 5-[(4-methoxyphenyl)carbamoyl]-4-methyl-2-[(2-methylfuran-3-carbonyl)amino]thiophene-3-carboxylate.
Chemical Property Profile of methyl 5-[(4-methoxyanilino)carbonyl]-4-methyl-2-[(2-methyl-3-furoyl)amino]thiophene-3-carboxylate
Property Insights of methyl 5-[(4-methoxyanilino)carbonyl]-4-methyl-2-[(2-methyl-3-furoyl)amino]thiophene-3-carboxylate
The XLogP value of 4.25774 indicates that methyl 5-[(4-methoxyanilino)carbonyl]-4-methyl-2-[(2-methyl-3-furoyl)amino]thiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.87 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 5-[(4-methoxyanilino)carbonyl]-4-methyl-2-[(2-methyl-3-furoyl)amino]thiophene-3-carboxylate. Following Lipinski's Rule of Five, methyl 5-[(4-methoxyanilino)carbonyl]-4-methyl-2-[(2-methyl-3-furoyl)amino]thiophene-3-carboxylate has 2 hydrogen bond donor(s) and 7 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 5-[(4-methoxyanilino)carbonyl]-4-methyl-2-[(2-methyl-3-furoyl)amino]thiophene-3-carboxylate?
The CAS number of methyl 5-[(4-methoxyanilino)carbonyl]-4-methyl-2-[(2-methyl-3-furoyl)amino]thiophene-3-carboxylate is 445013-88-7.
What is the molecular formula of methyl 5-[(4-methoxyanilino)carbonyl]-4-methyl-2-[(2-methyl-3-furoyl)amino]thiophene-3-carboxylate?
The molecular formula of methyl 5-[(4-methoxyanilino)carbonyl]-4-methyl-2-[(2-methyl-3-furoyl)amino]thiophene-3-carboxylate is C21H20N2O6S.
What is the molecular weight of methyl 5-[(4-methoxyanilino)carbonyl]-4-methyl-2-[(2-methyl-3-furoyl)amino]thiophene-3-carboxylate?
The molecular weight of methyl 5-[(4-methoxyanilino)carbonyl]-4-methyl-2-[(2-methyl-3-furoyl)amino]thiophene-3-carboxylate is 428.10 g/mol.
Where can I buy methyl 5-[(4-methoxyanilino)carbonyl]-4-methyl-2-[(2-methyl-3-furoyl)amino]thiophene-3-carboxylate?
You can request a quote for methyl 5-[(4-methoxyanilino)carbonyl]-4-methyl-2-[(2-methyl-3-furoyl)amino]thiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 5-[(4-methoxyanilino)carbonyl]-4-methyl-2-[(2-methyl-3-furoyl)amino]thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 5-[(4-methoxyanilino)carbonyl]-4-methyl-2-[(2-methyl-3-furoyl)amino]thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.