![3-thiophenecarboxylic acid, 2-[(3-carboxy-1-oxopropyl)amino]-4-(4-methoxyphenyl)-, 3-ethyl ester structure](/static/products/5158/515832-40-3.webp)
3-thiophenecarboxylic acid, 2-[(3-carboxy-1-oxopropyl)amino]-4-(4-methoxyphenyl)-, 3-ethyl ester
TL;DR: 3-thiophenecarboxylic acid, 2-[(3-carboxy-1-oxopropyl)amino]-4-(4-methoxyphenyl)-, 3-ethyl ester (CAS 515832-40-3) is a chemical compound with molecular formula C18H19NO6S and molecular weight 377.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[3-ethoxycarbonyl-4-(4-methoxyphenyl)thiophen-2-yl]amino]-4-oxobutanoic acid
Also Known As: 3-thiophenecarboxylic acid, 2-[(3-carboxy-1-oxopropyl)amino]-4-(4-methoxyphenyl)-, 3-ethyl ester, 3-[[3-ethoxycarbonyl-4-(4-methoxyphenyl)thiophen-2-yl]carbamoyl]propanoic Acid, 3-{[3-(ETHOXYCARBONYL)-4-(4-METHOXYPHENYL)THIOPHEN-2-YL]CARBAMOYL}PROPANOIC ACID, 3-{N-[3-(ethoxycarbonyl)-4-(4-methoxyphenyl)-2-thienyl]carbamoyl}propanoic aci d, 4-[[3-(ETHOXYCARBONYL)-4-(4-METHOXYPHENYL)-2-THIENYL]AMINO]-4-OXOBUTANOIC ACID
| Molecular Formula | C18H19NO6S |
|---|---|
| Molecular Weight | 377.09 g/mol |
| LogP | 3.4037 |
| Topological Polar Surface Area | 101.93 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 377.09332 |
| Heavy Atoms | 26 |
| Complexity | 796.5127 |
Chemical Identifiers
| CAS Number | 515832-40-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)OC)NC(=O)CCC(=O)O |
Product Overview
3-thiophenecarboxylic acid, 2-[(3-carboxy-1-oxopropyl)amino]-4-(4-methoxyphenyl)-, 3-ethyl ester (CAS 515832-40-3), with molecular formula C18H19NO6S and molecular weight 377.09 g/mol. IUPAC: 4-[[3-ethoxycarbonyl-4-(4-methoxyphenyl)thiophen-2-yl]amino]-4-oxobutanoic acid.
Chemical Property Profile of 3-thiophenecarboxylic acid, 2-[(3-carboxy-1-oxopropyl)amino]-4-(4-methoxyphenyl)-, 3-ethyl ester
Property Insights of 3-thiophenecarboxylic acid, 2-[(3-carboxy-1-oxopropyl)amino]-4-(4-methoxyphenyl)-, 3-ethyl ester
The XLogP value of 3.4037 indicates that 3-thiophenecarboxylic acid, 2-[(3-carboxy-1-oxopropyl)amino]-4-(4-methoxyphenyl)-, 3-ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-thiophenecarboxylic acid, 2-[(3-carboxy-1-oxopropyl)amino]-4-(4-methoxyphenyl)-, 3-ethyl ester. Following Lipinski's Rule of Five, 3-thiophenecarboxylic acid, 2-[(3-carboxy-1-oxopropyl)amino]-4-(4-methoxyphenyl)-, 3-ethyl ester has 2 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 3-thiophenecarboxylic acid, 2-[(3-carboxy-1-oxopropyl)amino]-4-(4-methoxyphenyl)-, 3-ethyl ester?
The CAS number of 3-thiophenecarboxylic acid, 2-[(3-carboxy-1-oxopropyl)amino]-4-(4-methoxyphenyl)-, 3-ethyl ester is 515832-40-3.
What is the molecular formula of 3-thiophenecarboxylic acid, 2-[(3-carboxy-1-oxopropyl)amino]-4-(4-methoxyphenyl)-, 3-ethyl ester?
The molecular formula of 3-thiophenecarboxylic acid, 2-[(3-carboxy-1-oxopropyl)amino]-4-(4-methoxyphenyl)-, 3-ethyl ester is C18H19NO6S.
What is the molecular weight of 3-thiophenecarboxylic acid, 2-[(3-carboxy-1-oxopropyl)amino]-4-(4-methoxyphenyl)-, 3-ethyl ester?
The molecular weight of 3-thiophenecarboxylic acid, 2-[(3-carboxy-1-oxopropyl)amino]-4-(4-methoxyphenyl)-, 3-ethyl ester is 377.09 g/mol.
Where can I buy 3-thiophenecarboxylic acid, 2-[(3-carboxy-1-oxopropyl)amino]-4-(4-methoxyphenyl)-, 3-ethyl ester?
You can request a quote for 3-thiophenecarboxylic acid, 2-[(3-carboxy-1-oxopropyl)amino]-4-(4-methoxyphenyl)-, 3-ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-thiophenecarboxylic acid, 2-[(3-carboxy-1-oxopropyl)amino]-4-(4-methoxyphenyl)-, 3-ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 3-thiophenecarboxylic acid, 2-[(3-carboxy-1-oxopropyl)amino]-4-(4-methoxyphenyl)-, 3-ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.