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Methyl 3-[(anilinocarbonyl)amino]-4-methyl-2-thiophenecarboxylate
TL;DR: Methyl 3-[(anilinocarbonyl)amino]-4-methyl-2-thiophenecarboxylate (CAS 478258-56-9) is a chemical compound with molecular formula C14H14N2O3S and molecular weight 290.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-methyl-3-(phenylcarbamoylamino)thiophene-2-carboxylate
Also Known As: methyl 3-[(anilinocarbonyl)amino]-4-methyl-2-thiophenecarboxylate, methyl 4-methyl-3-[(phenylcarbamoyl)amino]thiophene-2-carboxylate, methyl 4-methyl-3-(phenylcarbamoylamino)thiophene-2-carboxylate, methyl4-methyl-3-[(phenylcarbamoyl)amino]thiophene-2-carboxylate
| Molecular Formula | C14H14N2O3S |
|---|---|
| Molecular Weight | 290.07 g/mol |
| LogP | 3.48712 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 290.0725 |
| Heavy Atoms | 20 |
| Complexity | 622.6042 |
Chemical Identifiers
| CAS Number | 478258-56-9 |
|---|---|
| SMILES | CC1=CSC(=C1NC(=O)NC2=CC=CC=C2)C(=O)OC |
Product Overview
Methyl 3-[(anilinocarbonyl)amino]-4-methyl-2-thiophenecarboxylate (CAS 478258-56-9), with molecular formula C14H14N2O3S and molecular weight 290.07 g/mol. IUPAC: methyl 4-methyl-3-(phenylcarbamoylamino)thiophene-2-carboxylate.
Chemical Property Profile of Methyl 3-[(anilinocarbonyl)amino]-4-methyl-2-thiophenecarboxylate
Property Insights of Methyl 3-[(anilinocarbonyl)amino]-4-methyl-2-thiophenecarboxylate
The XLogP value of 3.48712 indicates that Methyl 3-[(anilinocarbonyl)amino]-4-methyl-2-thiophenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-[(anilinocarbonyl)amino]-4-methyl-2-thiophenecarboxylate. Following Lipinski's Rule of Five, Methyl 3-[(anilinocarbonyl)amino]-4-methyl-2-thiophenecarboxylate has 2 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 Methyl 3-[(anilinocarbonyl)amino]-4-methyl-2-thiophenecarboxylate?
The CAS number of Methyl 3-[(anilinocarbonyl)amino]-4-methyl-2-thiophenecarboxylate is 478258-56-9.
What is the molecular formula of Methyl 3-[(anilinocarbonyl)amino]-4-methyl-2-thiophenecarboxylate?
The molecular formula of Methyl 3-[(anilinocarbonyl)amino]-4-methyl-2-thiophenecarboxylate is C14H14N2O3S.
What is the molecular weight of Methyl 3-[(anilinocarbonyl)amino]-4-methyl-2-thiophenecarboxylate?
The molecular weight of Methyl 3-[(anilinocarbonyl)amino]-4-methyl-2-thiophenecarboxylate is 290.07 g/mol.
Where can I buy Methyl 3-[(anilinocarbonyl)amino]-4-methyl-2-thiophenecarboxylate?
You can request a quote for Methyl 3-[(anilinocarbonyl)amino]-4-methyl-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-[(anilinocarbonyl)amino]-4-methyl-2-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-[(anilinocarbonyl)amino]-4-methyl-2-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.