2-Thiopheneacetic acid, 4-carboxy-5-cinnamamido-3-methyl-
TL;DR: 2-Thiopheneacetic acid, 4-carboxy-5-cinnamamido-3-methyl- (CAS 105522-87-0) is a chemical compound with molecular formula C17H15NO5S and molecular weight 345.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(carboxymethyl)-4-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylic acid
Also Known As: 4-Carboxy-5-cinnamamido-3-methyl-2-thiopheneacetic acid, 2-Thiopheneacetic acid, 4-carboxy-5-cinnamamido-3-methyl-, 2-Thiopheneacetic acid, 4-carboxy-3-methyl-5-((1-oxo-3-phenyl-2-propenyl)amino)-, 5-(carboxymethyl)-4-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylic acid, RefChem:1064848
| Molecular Formula | C17H15NO5S |
|---|---|
| Molecular Weight | 345.07 g/mol |
| LogP | 3.03372 |
| Topological Polar Surface Area | 103.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 345.0671 |
| Heavy Atoms | 24 |
| Complexity | 807.8884 |
Chemical Identifiers
| CAS Number | 105522-87-0 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)O)NC(=O)/C=C/C2=CC=CC=C2)CC(=O)O |
Product Overview
2-Thiopheneacetic acid, 4-carboxy-5-cinnamamido-3-methyl- (CAS 105522-87-0), with molecular formula C17H15NO5S and molecular weight 345.07 g/mol. IUPAC: 5-(carboxymethyl)-4-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylic acid.
Chemical Property Profile of 2-Thiopheneacetic acid, 4-carboxy-5-cinnamamido-3-methyl-
Property Insights of 2-Thiopheneacetic acid, 4-carboxy-5-cinnamamido-3-methyl-
The XLogP value of 3.03372 indicates that 2-Thiopheneacetic acid, 4-carboxy-5-cinnamamido-3-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Thiopheneacetic acid, 4-carboxy-5-cinnamamido-3-methyl-. Following Lipinski's Rule of Five, 2-Thiopheneacetic acid, 4-carboxy-5-cinnamamido-3-methyl- has 3 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 2-Thiopheneacetic acid, 4-carboxy-5-cinnamamido-3-methyl-?
The CAS number of 2-Thiopheneacetic acid, 4-carboxy-5-cinnamamido-3-methyl- is 105522-87-0.
What is the molecular formula of 2-Thiopheneacetic acid, 4-carboxy-5-cinnamamido-3-methyl-?
The molecular formula of 2-Thiopheneacetic acid, 4-carboxy-5-cinnamamido-3-methyl- is C17H15NO5S.
What is the molecular weight of 2-Thiopheneacetic acid, 4-carboxy-5-cinnamamido-3-methyl-?
The molecular weight of 2-Thiopheneacetic acid, 4-carboxy-5-cinnamamido-3-methyl- is 345.07 g/mol.
Where can I buy 2-Thiopheneacetic acid, 4-carboxy-5-cinnamamido-3-methyl-?
You can request a quote for 2-Thiopheneacetic acid, 4-carboxy-5-cinnamamido-3-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Thiopheneacetic acid, 4-carboxy-5-cinnamamido-3-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Thiopheneacetic acid, 4-carboxy-5-cinnamamido-3-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.