2-Thiopheneacetic acid, 4-carboxy-3-methyl-5-(2-phenylacetamido)-
TL;DR: 2-Thiopheneacetic acid, 4-carboxy-3-methyl-5-(2-phenylacetamido)- (CAS 105522-86-9) is a chemical compound with molecular formula C16H15NO5S and molecular weight 333.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(carboxymethyl)-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylic acid
Also Known As: 2-Thiopheneacetic acid, 4-carboxy-3-methyl-5-(2-phenylacetamido)-, 2-Phenylacetylamino-3-carboxy-4-methyl-5-thiopheneacetic acid, 4-Carboxy-3-methyl-2-(2-phenylacetamido)-2-thiopheneacetic acid, 2-Thiopheneacetic acid, 4-carboxy-3-methyl-5-((phenylacetyl)amino)-, 5-(CARBOXYMETHYL)-4-METHYL-2-(2-PHENYLACETAMIDO)THIOPHENE-3-CARBOXYLIC ACID
| Molecular Formula | C16H15NO5S |
|---|---|
| Molecular Weight | 333.07 g/mol |
| LogP | 2.56302 |
| Topological Polar Surface Area | 103.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 333.0671 |
| Heavy Atoms | 23 |
| Complexity | 751.3311 |
Chemical Identifiers
| CAS Number | 105522-86-9 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)O)NC(=O)CC2=CC=CC=C2)CC(=O)O |
Product Overview
2-Thiopheneacetic acid, 4-carboxy-3-methyl-5-(2-phenylacetamido)- (CAS 105522-86-9), with molecular formula C16H15NO5S and molecular weight 333.07 g/mol. IUPAC: 5-(carboxymethyl)-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylic acid.
Chemical Property Profile of 2-Thiopheneacetic acid, 4-carboxy-3-methyl-5-(2-phenylacetamido)-
Property Insights of 2-Thiopheneacetic acid, 4-carboxy-3-methyl-5-(2-phenylacetamido)-
The XLogP value of 2.56302 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Thiopheneacetic acid, 4-carboxy-3-methyl-5-(2-phenylacetamido)-. The TPSA of 103.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Thiopheneacetic acid, 4-carboxy-3-methyl-5-(2-phenylacetamido)-. Following Lipinski's Rule of Five, 2-Thiopheneacetic acid, 4-carboxy-3-methyl-5-(2-phenylacetamido)- 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-3-methyl-5-(2-phenylacetamido)-?
The CAS number of 2-Thiopheneacetic acid, 4-carboxy-3-methyl-5-(2-phenylacetamido)- is 105522-86-9.
What is the molecular formula of 2-Thiopheneacetic acid, 4-carboxy-3-methyl-5-(2-phenylacetamido)-?
The molecular formula of 2-Thiopheneacetic acid, 4-carboxy-3-methyl-5-(2-phenylacetamido)- is C16H15NO5S.
What is the molecular weight of 2-Thiopheneacetic acid, 4-carboxy-3-methyl-5-(2-phenylacetamido)-?
The molecular weight of 2-Thiopheneacetic acid, 4-carboxy-3-methyl-5-(2-phenylacetamido)- is 333.07 g/mol.
Where can I buy 2-Thiopheneacetic acid, 4-carboxy-3-methyl-5-(2-phenylacetamido)-?
You can request a quote for 2-Thiopheneacetic acid, 4-carboxy-3-methyl-5-(2-phenylacetamido)- 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-3-methyl-5-(2-phenylacetamido)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Thiopheneacetic acid, 4-carboxy-3-methyl-5-(2-phenylacetamido)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.