![6-{[4-(Methoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid structure](/static/products/3526/352644-32-7.webp)
6-{[4-(Methoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid
TL;DR: 6-{[4-(Methoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid (CAS 352644-32-7) is a chemical compound with molecular formula C16H17NO5 and molecular weight 303.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(4-methoxycarbonylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
Also Known As: BAS 06671441, 6-{[4-(methoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid, 6-((4-(methoxycarbonyl)phenyl)carbamoyl)cyclohex-3-enecarboxylic acid, 6-[(4-methoxycarbonylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid, 6-{[4-(methoxycarbonyl)phenyl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
| Molecular Formula | C16H17NO5 |
|---|---|
| Molecular Weight | 303.11 g/mol |
| LogP | 2.0787 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 303.1107 |
| Heavy Atoms | 22 |
| Complexity | 605.4671 |
Chemical Identifiers
| CAS Number | 352644-32-7 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)NC(=O)C2CC=CCC2C(=O)O |
Product Overview
6-{[4-(Methoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid (CAS 352644-32-7), with molecular formula C16H17NO5 and molecular weight 303.11 g/mol. IUPAC: 6-[(4-methoxycarbonylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid.
Chemical Property Profile of 6-{[4-(Methoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid
Property Insights of 6-{[4-(Methoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid
The XLogP value of 2.0787 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-{[4-(Methoxycarbonyl)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-{[4-(Methoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid. Following Lipinski's Rule of Five, 6-{[4-(Methoxycarbonyl)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-{[4-(Methoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid?
The CAS number of 6-{[4-(Methoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid is 352644-32-7.
What is the molecular formula of 6-{[4-(Methoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid?
The molecular formula of 6-{[4-(Methoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid is C16H17NO5.
What is the molecular weight of 6-{[4-(Methoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid?
The molecular weight of 6-{[4-(Methoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid is 303.11 g/mol.
Where can I buy 6-{[4-(Methoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid?
You can request a quote for 6-{[4-(Methoxycarbonyl)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-{[4-(Methoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-{[4-(Methoxycarbonyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.