![Methyl 2-[(chloroacetyl)amino]thiophene-3-carboxylate structure](/static/products/1057/105776-11-2.webp)
Methyl 2-[(chloroacetyl)amino]thiophene-3-carboxylate
TL;DR: Methyl 2-[(chloroacetyl)amino]thiophene-3-carboxylate (CAS 105776-11-2) is a chemical compound with molecular formula C8H8ClNO3S and molecular weight 232.99135 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-[(2-chloroacetyl)amino]thiophene-3-carboxylate
Also Known As: methyl 2-[(chloroacetyl)amino]thiophene-3-carboxylate, methyl 2-(2-chloroacetamido)thiophene-3-carboxylate, methyl 2-[(2-chloroacetyl)amino]thiophene-3-carboxylate, 4,6-Dimethoxy-1H-indole-2-carboxylic acid, methyl-2-chloroacetamidothiophene-3-carboxylate
Technical Specifications
| Molecular Formula | C8H8ClNO3S |
| Molecular Weight | 232.99135 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 83.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 232.99135 Da |
| Heavy Atoms | 14 |
| Complexity | 237.0 |
| SMILES | COC(=O)C1=C(SC=C1)NC(=O)CCl |
| InChIKey | PTLPUZFVMNXYIF-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 2-[(chloroacetyl)amino]thiophene-3-carboxylate
Property Insights of Methyl 2-[(chloroacetyl)amino]thiophene-3-carboxylate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-[(chloroacetyl)amino]thiophene-3-carboxylate. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[(chloroacetyl)amino]thiophene-3-carboxylate. Following Lipinski's Rule of Five, Methyl 2-[(chloroacetyl)amino]thiophene-3-carboxylate 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
What is the CAS number of Methyl 2-[(chloroacetyl)amino]thiophene-3-carboxylate?
The CAS number of Methyl 2-[(chloroacetyl)amino]thiophene-3-carboxylate is 105776-11-2.
What is the molecular formula of Methyl 2-[(chloroacetyl)amino]thiophene-3-carboxylate?
The molecular formula of Methyl 2-[(chloroacetyl)amino]thiophene-3-carboxylate is C8H8ClNO3S.
What is the molecular weight of Methyl 2-[(chloroacetyl)amino]thiophene-3-carboxylate?
The molecular weight of Methyl 2-[(chloroacetyl)amino]thiophene-3-carboxylate is 232.99135 g/mol.
Where can I buy Methyl 2-[(chloroacetyl)amino]thiophene-3-carboxylate?
You can request a quote for Methyl 2-[(chloroacetyl)amino]thiophene-3-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 2-[(chloroacetyl)amino]thiophene-3-carboxylate?
Yes, CoreyChem provides custom synthesis services for Methyl 2-[(chloroacetyl)amino]thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.