2-Thiopheneacetic acid, 5-benzamido-4-carboxy-3-methyl-
TL;DR: 2-Thiopheneacetic acid, 5-benzamido-4-carboxy-3-methyl- (CAS 105522-85-8) is a chemical compound with molecular formula C15H13NO5S and molecular weight 319.05145 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-benzamido-5-(carboxymethyl)-4-methylthiophene-3-carboxylic acid
Also Known As: 2-Thiopheneacetic acid, 5-benzamido-4-carboxy-3-methyl-, 2-Benzoylamino-3-carboxy-4-methyl-5-thiopheneacetic acid, 5-Benzamido-4-carboxy-3-methyl-2-thiopheneacetic acid, 2-Thiopheneacetic acid, 5-(benzoylamino)-4-carboxy-3-methyl-, 2-benzamido-5-(carboxymethyl)-4-methylthiophene-3-carboxylic acid
Technical Specifications
| Molecular Formula | C15H13NO5S |
| Molecular Weight | 319.05145 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 132.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 319.05145 Da |
| Heavy Atoms | 22 |
| Complexity | 449.0 |
| SMILES | CC1=C(SC(=C1C(=O)O)NC(=O)C2=CC=CC=C2)CC(=O)O |
| InChIKey | HYGZYOLPBRGOMB-UHFFFAOYSA-N |
Chemical Property Profile of 2-Thiopheneacetic acid, 5-benzamido-4-carboxy-3-methyl-
Property Insights of 2-Thiopheneacetic acid, 5-benzamido-4-carboxy-3-methyl-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Thiopheneacetic acid, 5-benzamido-4-carboxy-3-methyl-. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Thiopheneacetic acid, 5-benzamido-4-carboxy-3-methyl-. Following Lipinski's Rule of Five, 2-Thiopheneacetic acid, 5-benzamido-4-carboxy-3-methyl- has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Thiopheneacetic acid, 5-benzamido-4-carboxy-3-methyl-?
The CAS number of 2-Thiopheneacetic acid, 5-benzamido-4-carboxy-3-methyl- is 105522-85-8.
What is the molecular formula of 2-Thiopheneacetic acid, 5-benzamido-4-carboxy-3-methyl-?
The molecular formula of 2-Thiopheneacetic acid, 5-benzamido-4-carboxy-3-methyl- is C15H13NO5S.
What is the molecular weight of 2-Thiopheneacetic acid, 5-benzamido-4-carboxy-3-methyl-?
The molecular weight of 2-Thiopheneacetic acid, 5-benzamido-4-carboxy-3-methyl- is 319.05145 g/mol.
Where can I buy 2-Thiopheneacetic acid, 5-benzamido-4-carboxy-3-methyl-?
You can request a quote for 2-Thiopheneacetic acid, 5-benzamido-4-carboxy-3-methyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Thiopheneacetic acid, 5-benzamido-4-carboxy-3-methyl-?
Yes, CoreyChem provides custom synthesis services for 2-Thiopheneacetic acid, 5-benzamido-4-carboxy-3-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.