![6-{[2-(Ethoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid structure](/static/products/3137/313703-46-7.webp)
6-{[2-(Ethoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid
TL;DR: 6-{[2-(Ethoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid (CAS 313703-46-7) is a chemical compound with molecular formula C17H19NO5 and molecular weight 317.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(2-ethoxycarbonylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
Also Known As: 6-{[2-(ETHOXYCARBONYL)ANILINO]CARBONYL}-3-CYCLOHEXENE-1-CARBOXYLIC ACID, 6-[(2-ethoxycarbonylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylic Acid, benzoic acid, 2-[[(6-carboxy-3-cyclohexen-1-yl)carbonyl]amino]-, 1-ethyl ester, 6-{[2-(ethoxycarbonyl)phenyl]carbamoyl}cyclohex-3-ene-1-carboxylic acid, 6-{N-[2-(ethoxycarbonyl)phenyl]carbamoyl}cyclohex-3-enecarboxylic acid
| Molecular Formula | C17H19NO5 |
|---|---|
| Molecular Weight | 317.13 g/mol |
| LogP | 2.4688 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 317.1263 |
| Heavy Atoms | 23 |
| Complexity | 637.62585 |
Chemical Identifiers
| CAS Number | 313703-46-7 |
|---|---|
| SMILES | CCOC(=O)C1=CC=CC=C1NC(=O)C2CC=CCC2C(=O)O |
Product Overview
6-{[2-(Ethoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid (CAS 313703-46-7), with molecular formula C17H19NO5 and molecular weight 317.13 g/mol. IUPAC: 6-[(2-ethoxycarbonylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid.
Chemical Property Profile of 6-{[2-(Ethoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid
Property Insights of 6-{[2-(Ethoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid
The XLogP value of 2.4688 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-{[2-(Ethoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-{[2-(Ethoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid. Following Lipinski's Rule of Five, 6-{[2-(Ethoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid has 2 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 6-{[2-(Ethoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid?
The CAS number of 6-{[2-(Ethoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid is 313703-46-7.
What is the molecular formula of 6-{[2-(Ethoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid?
The molecular formula of 6-{[2-(Ethoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid is C17H19NO5.
What is the molecular weight of 6-{[2-(Ethoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid?
The molecular weight of 6-{[2-(Ethoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid is 317.13 g/mol.
Where can I buy 6-{[2-(Ethoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid?
You can request a quote for 6-{[2-(Ethoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-{[2-(Ethoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-{[2-(Ethoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.