2-({[4-ethyl-3-(methoxycarbonyl)-5-methyl-2-thienyl]amino}carbonyl)cyclohexanecarboxylic acid
TL;DR: 2-({[4-ethyl-3-(methoxycarbonyl)-5-methyl-2-thienyl]amino}carbonyl)cyclohexanecarboxylic acid (CAS 438463-11-7) is a chemical compound with molecular formula C17H23NO5S and molecular weight 353.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-ethyl-3-methoxycarbonyl-5-methylthiophen-2-yl)carbamoyl]cyclohexane-1-carboxylic acid
Also Known As: 2-({[4-ethyl-3-(methoxycarbonyl)-5-methyl-2-thienyl]amino}carbonyl)cyclohexanecarboxylic acid, 2-{[4-ethyl-3-(methoxycarbonyl)-5-methylthiophen-2-yl]carbamoyl}cyclohexanecarboxylic acid, 3-thiophenecarboxylic acid, 2-[[(2-carboxycyclohexyl)carbonyl]amino]-4-ethyl-5-methyl-, 3-methyl ester, 2-[(4-ethyl-3-methoxycarbonyl-5-methylthiophen-2-yl)carbamoyl]cyclohexane-1-carboxylic acid, 2-{N-[4-ethyl-3-(methoxycarbonyl)-5-methyl-2-thienyl]carbamoyl}cyclohexanecarb oxylic acid
| Molecular Formula | C17H23NO5S |
|---|---|
| Molecular Weight | 353.13 g/mol |
| LogP | 3.23502 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 353.1297 |
| Heavy Atoms | 24 |
| Complexity | 651.65125 |
Chemical Identifiers
| CAS Number | 438463-11-7 |
|---|---|
| SMILES | CCC1=C(SC(=C1C(=O)OC)NC(=O)C2CCCCC2C(=O)O)C |
Product Overview
2-({[4-ethyl-3-(methoxycarbonyl)-5-methyl-2-thienyl]amino}carbonyl)cyclohexanecarboxylic acid (CAS 438463-11-7), with molecular formula C17H23NO5S and molecular weight 353.13 g/mol. IUPAC: 2-[(4-ethyl-3-methoxycarbonyl-5-methylthiophen-2-yl)carbamoyl]cyclohexane-1-carboxylic acid.
Chemical Property Profile of 2-({[4-ethyl-3-(methoxycarbonyl)-5-methyl-2-thienyl]amino}carbonyl)cyclohexanecarboxylic acid
Property Insights of 2-({[4-ethyl-3-(methoxycarbonyl)-5-methyl-2-thienyl]amino}carbonyl)cyclohexanecarboxylic acid
The XLogP value of 3.23502 indicates that 2-({[4-ethyl-3-(methoxycarbonyl)-5-methyl-2-thienyl]amino}carbonyl)cyclohexanecarboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-({[4-ethyl-3-(methoxycarbonyl)-5-methyl-2-thienyl]amino}carbonyl)cyclohexanecarboxylic acid. Following Lipinski's Rule of Five, 2-({[4-ethyl-3-(methoxycarbonyl)-5-methyl-2-thienyl]amino}carbonyl)cyclohexanecarboxylic acid has 2 hydrogen bond donor(s) and 5 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-({[4-ethyl-3-(methoxycarbonyl)-5-methyl-2-thienyl]amino}carbonyl)cyclohexanecarboxylic acid?
The CAS number of 2-({[4-ethyl-3-(methoxycarbonyl)-5-methyl-2-thienyl]amino}carbonyl)cyclohexanecarboxylic acid is 438463-11-7.
What is the molecular formula of 2-({[4-ethyl-3-(methoxycarbonyl)-5-methyl-2-thienyl]amino}carbonyl)cyclohexanecarboxylic acid?
The molecular formula of 2-({[4-ethyl-3-(methoxycarbonyl)-5-methyl-2-thienyl]amino}carbonyl)cyclohexanecarboxylic acid is C17H23NO5S.
What is the molecular weight of 2-({[4-ethyl-3-(methoxycarbonyl)-5-methyl-2-thienyl]amino}carbonyl)cyclohexanecarboxylic acid?
The molecular weight of 2-({[4-ethyl-3-(methoxycarbonyl)-5-methyl-2-thienyl]amino}carbonyl)cyclohexanecarboxylic acid is 353.13 g/mol.
Where can I buy 2-({[4-ethyl-3-(methoxycarbonyl)-5-methyl-2-thienyl]amino}carbonyl)cyclohexanecarboxylic acid?
You can request a quote for 2-({[4-ethyl-3-(methoxycarbonyl)-5-methyl-2-thienyl]amino}carbonyl)cyclohexanecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-({[4-ethyl-3-(methoxycarbonyl)-5-methyl-2-thienyl]amino}carbonyl)cyclohexanecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-({[4-ethyl-3-(methoxycarbonyl)-5-methyl-2-thienyl]amino}carbonyl)cyclohexanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.