Methyl 2-({2-[(4-methoxyanilino)carbonyl]-3-thienyl}sulfanyl)acetate
TL;DR: Methyl 2-({2-[(4-methoxyanilino)carbonyl]-3-thienyl}sulfanyl)acetate (CAS 251097-13-9) is a chemical compound with molecular formula C15H15NO4S2 and molecular weight 337.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[2-[(4-methoxyphenyl)carbamoyl]thiophen-3-yl]sulfanylacetate
Also Known As: 10G-457S, methyl 2-({2-[(4-methoxyanilino)carbonyl]-3-thienyl}sulfanyl)acetate, methyl 2-[2-[(4-methoxyphenyl)carbamoyl]thiophen-3-yl]sulfanylacetate, methyl 2-({2-[(4-methoxyphenyl)carbamoyl]thiophen-3-yl}sulfanyl)acetate, Methyl ({2-[(4-methoxyphenyl)carbamoyl]thiophen-3-yl}sulfanyl)acetate
| Molecular Formula | C15H15NO4S2 |
|---|---|
| Molecular Weight | 337.04 g/mol |
| LogP | 3.2741 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 337.04425 |
| Heavy Atoms | 22 |
| Complexity | 651.817 |
Chemical Identifiers
| CAS Number | 251097-13-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)C2=C(C=CS2)SCC(=O)OC |
Product Overview
Methyl 2-({2-[(4-methoxyanilino)carbonyl]-3-thienyl}sulfanyl)acetate (CAS 251097-13-9), with molecular formula C15H15NO4S2 and molecular weight 337.04 g/mol. IUPAC: methyl 2-[2-[(4-methoxyphenyl)carbamoyl]thiophen-3-yl]sulfanylacetate.
Chemical Property Profile of Methyl 2-({2-[(4-methoxyanilino)carbonyl]-3-thienyl}sulfanyl)acetate
Property Insights of Methyl 2-({2-[(4-methoxyanilino)carbonyl]-3-thienyl}sulfanyl)acetate
The XLogP value of 3.2741 indicates that Methyl 2-({2-[(4-methoxyanilino)carbonyl]-3-thienyl}sulfanyl)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-({2-[(4-methoxyanilino)carbonyl]-3-thienyl}sulfanyl)acetate. Following Lipinski's Rule of Five, Methyl 2-({2-[(4-methoxyanilino)carbonyl]-3-thienyl}sulfanyl)acetate has 1 hydrogen bond donor(s) and 6 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 Methyl 2-({2-[(4-methoxyanilino)carbonyl]-3-thienyl}sulfanyl)acetate?
The CAS number of Methyl 2-({2-[(4-methoxyanilino)carbonyl]-3-thienyl}sulfanyl)acetate is 251097-13-9.
What is the molecular formula of Methyl 2-({2-[(4-methoxyanilino)carbonyl]-3-thienyl}sulfanyl)acetate?
The molecular formula of Methyl 2-({2-[(4-methoxyanilino)carbonyl]-3-thienyl}sulfanyl)acetate is C15H15NO4S2.
What is the molecular weight of Methyl 2-({2-[(4-methoxyanilino)carbonyl]-3-thienyl}sulfanyl)acetate?
The molecular weight of Methyl 2-({2-[(4-methoxyanilino)carbonyl]-3-thienyl}sulfanyl)acetate is 337.04 g/mol.
Where can I buy Methyl 2-({2-[(4-methoxyanilino)carbonyl]-3-thienyl}sulfanyl)acetate?
You can request a quote for Methyl 2-({2-[(4-methoxyanilino)carbonyl]-3-thienyl}sulfanyl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-({2-[(4-methoxyanilino)carbonyl]-3-thienyl}sulfanyl)acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-({2-[(4-methoxyanilino)carbonyl]-3-thienyl}sulfanyl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.