Methyl 3-((4-methylbenzoyl)amino)-2-thiophenecarboxylate
TL;DR: Methyl 3-((4-methylbenzoyl)amino)-2-thiophenecarboxylate (CAS 478080-01-2) is a chemical compound with molecular formula C14H13NO3S and molecular weight 275.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[(4-methylbenzoyl)amino]thiophene-2-carboxylate
Also Known As: Bionet2_001075, methyl 3-[(4-methylbenzoyl)amino]-2-thiophenecarboxylate, methyl 3-(4-methylbenzamido)thiophene-2-carboxylate, methyl 3-[(4-methylbenzoyl)amino]thiophene-2-carboxylate, methyl3-(4-methylbenzamido)thiophene-2-carboxylate
| Molecular Formula | C14H13NO3S |
|---|---|
| Molecular Weight | 275.06 g/mol |
| LogP | 3.09542 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 275.0616 |
| Heavy Atoms | 19 |
| Complexity | 601.40857 |
Chemical Identifiers
| CAS Number | 478080-01-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NC2=C(SC=C2)C(=O)OC |
Product Overview
Methyl 3-((4-methylbenzoyl)amino)-2-thiophenecarboxylate (CAS 478080-01-2), with molecular formula C14H13NO3S and molecular weight 275.06 g/mol. IUPAC: methyl 3-[(4-methylbenzoyl)amino]thiophene-2-carboxylate.
Chemical Property Profile of Methyl 3-((4-methylbenzoyl)amino)-2-thiophenecarboxylate
Property Insights of Methyl 3-((4-methylbenzoyl)amino)-2-thiophenecarboxylate
The XLogP value of 3.09542 indicates that Methyl 3-((4-methylbenzoyl)amino)-2-thiophenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, Methyl 3-((4-methylbenzoyl)amino)-2-thiophenecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-((4-methylbenzoyl)amino)-2-thiophenecarboxylate has 1 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-((4-methylbenzoyl)amino)-2-thiophenecarboxylate?
The CAS number of Methyl 3-((4-methylbenzoyl)amino)-2-thiophenecarboxylate is 478080-01-2.
What is the molecular formula of Methyl 3-((4-methylbenzoyl)amino)-2-thiophenecarboxylate?
The molecular formula of Methyl 3-((4-methylbenzoyl)amino)-2-thiophenecarboxylate is C14H13NO3S.
What is the molecular weight of Methyl 3-((4-methylbenzoyl)amino)-2-thiophenecarboxylate?
The molecular weight of Methyl 3-((4-methylbenzoyl)amino)-2-thiophenecarboxylate is 275.06 g/mol.
Where can I buy Methyl 3-((4-methylbenzoyl)amino)-2-thiophenecarboxylate?
You can request a quote for Methyl 3-((4-methylbenzoyl)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-methylbenzoyl)amino)-2-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-((4-methylbenzoyl)amino)-2-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.