Methyl 2-(benzoylamino)-5-benzyl-4-methyl-3-thiophenecarboxylate
TL;DR: Methyl 2-(benzoylamino)-5-benzyl-4-methyl-3-thiophenecarboxylate (CAS 308293-37-0) is a chemical compound with molecular formula C21H19NO3S and molecular weight 365.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-benzamido-5-benzyl-4-methylthiophene-3-carboxylate
Also Known As: methyl 2-(benzoylamino)-5-benzyl-4-methyl-3-thiophenecarboxylate, methyl 2-benzamido-5-benzyl-4-methylthiophene-3-carboxylate, methyl 4-methyl-2-(phenylcarbonylamino)-5-benzylthiophene-3-carboxylate, methyl 5-benzyl-4-methyl-2-[(phenylcarbonyl)amino]thiophene-3-carboxylate
| Molecular Formula | C21H19NO3S |
|---|---|
| Molecular Weight | 365.11 g/mol |
| LogP | 4.68622 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 365.10855 |
| Heavy Atoms | 26 |
| Complexity | 917.1891 |
Chemical Identifiers
| CAS Number | 308293-37-0 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=CC=C2)CC3=CC=CC=C3 |
Product Overview
Methyl 2-(benzoylamino)-5-benzyl-4-methyl-3-thiophenecarboxylate (CAS 308293-37-0), with molecular formula C21H19NO3S and molecular weight 365.11 g/mol. IUPAC: methyl 2-benzamido-5-benzyl-4-methylthiophene-3-carboxylate.
Chemical Property Profile of Methyl 2-(benzoylamino)-5-benzyl-4-methyl-3-thiophenecarboxylate
Property Insights of Methyl 2-(benzoylamino)-5-benzyl-4-methyl-3-thiophenecarboxylate
The XLogP value of 4.68622 indicates that Methyl 2-(benzoylamino)-5-benzyl-4-methyl-3-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 2-(benzoylamino)-5-benzyl-4-methyl-3-thiophenecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-(benzoylamino)-5-benzyl-4-methyl-3-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 2-(benzoylamino)-5-benzyl-4-methyl-3-thiophenecarboxylate?
The CAS number of Methyl 2-(benzoylamino)-5-benzyl-4-methyl-3-thiophenecarboxylate is 308293-37-0.
What is the molecular formula of Methyl 2-(benzoylamino)-5-benzyl-4-methyl-3-thiophenecarboxylate?
The molecular formula of Methyl 2-(benzoylamino)-5-benzyl-4-methyl-3-thiophenecarboxylate is C21H19NO3S.
What is the molecular weight of Methyl 2-(benzoylamino)-5-benzyl-4-methyl-3-thiophenecarboxylate?
The molecular weight of Methyl 2-(benzoylamino)-5-benzyl-4-methyl-3-thiophenecarboxylate is 365.11 g/mol.
Where can I buy Methyl 2-(benzoylamino)-5-benzyl-4-methyl-3-thiophenecarboxylate?
You can request a quote for Methyl 2-(benzoylamino)-5-benzyl-4-methyl-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-(benzoylamino)-5-benzyl-4-methyl-3-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(benzoylamino)-5-benzyl-4-methyl-3-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.