Propan-2-yl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate
TL;DR: Propan-2-yl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate (CAS 351156-62-2) is a chemical compound with molecular formula C11H15NO3S and molecular weight 241.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate
Also Known As: propan-2-yl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate, BIM-0021717.P001, isopropyl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate, isopropyl 5-acetyl-2-amino-4-methyl-3-thiophenecarboxylate, methylethyl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate
| Molecular Formula | C11H15NO3S |
|---|---|
| Molecular Weight | 241.08 g/mol |
| LogP | 2.40652 |
| Topological Polar Surface Area | 69.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 241.07727 |
| Heavy Atoms | 16 |
| Complexity | 434.68323 |
Chemical Identifiers
| CAS Number | 351156-62-2 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC(C)C)N)C(=O)C |
Product Overview
Propan-2-yl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate (CAS 351156-62-2), with molecular formula C11H15NO3S and molecular weight 241.08 g/mol. IUPAC: propan-2-yl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate.
Chemical Property Profile of Propan-2-yl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate
Property Insights of Propan-2-yl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate
The XLogP value of 2.40652 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propan-2-yl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate. The TPSA of 69.39 Ų falls within the moderate polarity range, balancing permeability and solubility for Propan-2-yl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate. Following Lipinski's Rule of Five, Propan-2-yl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate 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 Propan-2-yl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate?
The CAS number of Propan-2-yl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate is 351156-62-2.
What is the molecular formula of Propan-2-yl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate?
The molecular formula of Propan-2-yl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate is C11H15NO3S.
What is the molecular weight of Propan-2-yl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate?
The molecular weight of Propan-2-yl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate is 241.08 g/mol.
Where can I buy Propan-2-yl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate?
You can request a quote for Propan-2-yl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propan-2-yl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Propan-2-yl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.