Methyl 3-[(bicyclo[2.2.1]hept-2-ylcarbonyl)amino]-2-thiophenecarboxylate
TL;DR: Methyl 3-[(bicyclo[2.2.1]hept-2-ylcarbonyl)amino]-2-thiophenecarboxylate (CAS 489408-73-3) is a chemical compound with molecular formula C14H17NO3S and molecular weight 279.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(bicyclo[2.2.1]heptane-2-carbonylamino)thiophene-2-carboxylate
Also Known As: methyl 3-[(bicyclo[2.2.1]hept-2-ylcarbonyl)amino]-2-thiophenecarboxylate, methyl 3-[(bicyclo[2.2.1]hept-2-ylcarbonyl)amino]thiophene-2-carboxylate, methyl 3-(bicyclo[2.2.1]hept-2-ylcarbonylamino)thiophene-2-carboxylate, methyl 3-(bicyclo[2.2.1]heptane-2-carboxamido)thiophene-2-carboxylate, methyl 3-(bicyclo[2.2.1]heptane-3-carbonylamino)thiophene-2-carboxylate
| Molecular Formula | C14H17NO3S |
|---|---|
| Molecular Weight | 279.09 g/mol |
| LogP | 2.9094 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 279.09293 |
| Heavy Atoms | 19 |
| Complexity | 510.54428 |
Chemical Identifiers
| CAS Number | 489408-73-3 |
|---|---|
| SMILES | COC(=O)C1=C(C=CS1)NC(=O)C2CC3CCC2C3 |
Product Overview
Methyl 3-[(bicyclo[2.2.1]hept-2-ylcarbonyl)amino]-2-thiophenecarboxylate (CAS 489408-73-3), with molecular formula C14H17NO3S and molecular weight 279.09 g/mol. IUPAC: methyl 3-(bicyclo[2.2.1]heptane-2-carbonylamino)thiophene-2-carboxylate.
Chemical Property Profile of Methyl 3-[(bicyclo[2.2.1]hept-2-ylcarbonyl)amino]-2-thiophenecarboxylate
Property Insights of Methyl 3-[(bicyclo[2.2.1]hept-2-ylcarbonyl)amino]-2-thiophenecarboxylate
The XLogP value of 2.9094 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-[(bicyclo[2.2.1]hept-2-ylcarbonyl)amino]-2-thiophenecarboxylate. With a topological polar surface area (TPSA) of 55.4 Ų, Methyl 3-[(bicyclo[2.2.1]hept-2-ylcarbonyl)amino]-2-thiophenecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-[(bicyclo[2.2.1]hept-2-ylcarbonyl)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-[(bicyclo[2.2.1]hept-2-ylcarbonyl)amino]-2-thiophenecarboxylate?
The CAS number of Methyl 3-[(bicyclo[2.2.1]hept-2-ylcarbonyl)amino]-2-thiophenecarboxylate is 489408-73-3.
What is the molecular formula of Methyl 3-[(bicyclo[2.2.1]hept-2-ylcarbonyl)amino]-2-thiophenecarboxylate?
The molecular formula of Methyl 3-[(bicyclo[2.2.1]hept-2-ylcarbonyl)amino]-2-thiophenecarboxylate is C14H17NO3S.
What is the molecular weight of Methyl 3-[(bicyclo[2.2.1]hept-2-ylcarbonyl)amino]-2-thiophenecarboxylate?
The molecular weight of Methyl 3-[(bicyclo[2.2.1]hept-2-ylcarbonyl)amino]-2-thiophenecarboxylate is 279.09 g/mol.
Where can I buy Methyl 3-[(bicyclo[2.2.1]hept-2-ylcarbonyl)amino]-2-thiophenecarboxylate?
You can request a quote for Methyl 3-[(bicyclo[2.2.1]hept-2-ylcarbonyl)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-[(bicyclo[2.2.1]hept-2-ylcarbonyl)amino]-2-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-[(bicyclo[2.2.1]hept-2-ylcarbonyl)amino]-2-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.