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2-[(2-Thienylcarbonyl)amino]benzyl 2-thiophenecarboxylate
TL;DR: 2-[(2-Thienylcarbonyl)amino]benzyl 2-thiophenecarboxylate (CAS 505052-75-5) is a chemical compound with molecular formula C17H13NO3S2 and molecular weight 343.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(thiophene-2-carbonylamino)phenyl]methyl thiophene-2-carboxylate
Also Known As: 2-[(2-thienylcarbonyl)amino]benzyl 2-thiophenecarboxylate, AO-435/42299913, [2-(thiophene-2-carbonylamino)phenyl]methyl thiophene-2-carboxylate
| Molecular Formula | C17H13NO3S2 |
|---|---|
| Molecular Weight | 343.03 g/mol |
| LogP | 4.4189 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 343.0337 |
| Heavy Atoms | 23 |
| Complexity | 795.12994 |
Chemical Identifiers
| CAS Number | 505052-75-5 |
|---|---|
| SMILES | C1=CC=C(C(=C1)COC(=O)C2=CC=CS2)NC(=O)C3=CC=CS3 |
Product Overview
2-[(2-Thienylcarbonyl)amino]benzyl 2-thiophenecarboxylate (CAS 505052-75-5), with molecular formula C17H13NO3S2 and molecular weight 343.03 g/mol. IUPAC: [2-(thiophene-2-carbonylamino)phenyl]methyl thiophene-2-carboxylate.
Chemical Property Profile of 2-[(2-Thienylcarbonyl)amino]benzyl 2-thiophenecarboxylate
Property Insights of 2-[(2-Thienylcarbonyl)amino]benzyl 2-thiophenecarboxylate
The XLogP value of 4.4189 indicates that 2-[(2-Thienylcarbonyl)amino]benzyl 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, 2-[(2-Thienylcarbonyl)amino]benzyl 2-thiophenecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(2-Thienylcarbonyl)amino]benzyl 2-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 2-[(2-Thienylcarbonyl)amino]benzyl 2-thiophenecarboxylate?
The CAS number of 2-[(2-Thienylcarbonyl)amino]benzyl 2-thiophenecarboxylate is 505052-75-5.
What is the molecular formula of 2-[(2-Thienylcarbonyl)amino]benzyl 2-thiophenecarboxylate?
The molecular formula of 2-[(2-Thienylcarbonyl)amino]benzyl 2-thiophenecarboxylate is C17H13NO3S2.
What is the molecular weight of 2-[(2-Thienylcarbonyl)amino]benzyl 2-thiophenecarboxylate?
The molecular weight of 2-[(2-Thienylcarbonyl)amino]benzyl 2-thiophenecarboxylate is 343.03 g/mol.
Where can I buy 2-[(2-Thienylcarbonyl)amino]benzyl 2-thiophenecarboxylate?
You can request a quote for 2-[(2-Thienylcarbonyl)amino]benzyl 2-thiophenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2-Thienylcarbonyl)amino]benzyl 2-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2-Thienylcarbonyl)amino]benzyl 2-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.