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Methyl 3-[(cyclohexylcarbamoyl)amino]thiophene-2-carboxylate
TL;DR: Methyl 3-[(cyclohexylcarbamoyl)amino]thiophene-2-carboxylate (CAS 544701-60-2) is a chemical compound with molecular formula C13H18N2O3S and molecular weight 282.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(cyclohexylcarbamoylamino)thiophene-2-carboxylate
Also Known As: methyl 3-[(cyclohexylcarbamoyl)amino]thiophene-2-carboxylate, Methyl 3-(cyclohexylcarbamoylamino)thiophene-2-carboxylate, METHYL 3-((CYCLOHEXYLAMINO)CARBONYLAMINO)THIOPHENE-2-CARBOXYLATE, Methyl 3-(3-cyclohexylureido)thiophene-2-carboxylate, methyl 3-[(N-cyclohexylcarbamoyl)amino]thiophene-2-carboxylate
| Molecular Formula | C13H18N2O3S |
|---|---|
| Molecular Weight | 282.10 g/mol |
| LogP | 2.9889 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.10382 |
| Heavy Atoms | 19 |
| Complexity | 452.49573 |
Chemical Identifiers
| CAS Number | 544701-60-2 |
|---|---|
| SMILES | COC(=O)C1=C(C=CS1)NC(=O)NC2CCCCC2 |
Product Overview
Methyl 3-[(cyclohexylcarbamoyl)amino]thiophene-2-carboxylate (CAS 544701-60-2), with molecular formula C13H18N2O3S and molecular weight 282.10 g/mol. IUPAC: methyl 3-(cyclohexylcarbamoylamino)thiophene-2-carboxylate.
Chemical Property Profile of Methyl 3-[(cyclohexylcarbamoyl)amino]thiophene-2-carboxylate
Property Insights of Methyl 3-[(cyclohexylcarbamoyl)amino]thiophene-2-carboxylate
The XLogP value of 2.9889 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-[(cyclohexylcarbamoyl)amino]thiophene-2-carboxylate. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-[(cyclohexylcarbamoyl)amino]thiophene-2-carboxylate. Following Lipinski's Rule of Five, Methyl 3-[(cyclohexylcarbamoyl)amino]thiophene-2-carboxylate 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-[(cyclohexylcarbamoyl)amino]thiophene-2-carboxylate?
The CAS number of Methyl 3-[(cyclohexylcarbamoyl)amino]thiophene-2-carboxylate is 544701-60-2.
What is the molecular formula of Methyl 3-[(cyclohexylcarbamoyl)amino]thiophene-2-carboxylate?
The molecular formula of Methyl 3-[(cyclohexylcarbamoyl)amino]thiophene-2-carboxylate is C13H18N2O3S.
What is the molecular weight of Methyl 3-[(cyclohexylcarbamoyl)amino]thiophene-2-carboxylate?
The molecular weight of Methyl 3-[(cyclohexylcarbamoyl)amino]thiophene-2-carboxylate is 282.10 g/mol.
Where can I buy Methyl 3-[(cyclohexylcarbamoyl)amino]thiophene-2-carboxylate?
You can request a quote for Methyl 3-[(cyclohexylcarbamoyl)amino]thiophene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-[(cyclohexylcarbamoyl)amino]thiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-[(cyclohexylcarbamoyl)amino]thiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.