![6-({[3-(isopropoxycarbonyl)-4-(4-methylphenyl)thien-2-yl]amino}carbonyl)cyclohex-3-ene-1-carboxylic acid structure](/static/products/3510/351000-50-5.webp)
6-({[3-(isopropoxycarbonyl)-4-(4-methylphenyl)thien-2-yl]amino}carbonyl)cyclohex-3-ene-1-carboxylic acid
TL;DR: 6-({[3-(isopropoxycarbonyl)-4-(4-methylphenyl)thien-2-yl]amino}carbonyl)cyclohex-3-ene-1-carboxylic acid (CAS 351000-50-5) is a chemical compound with molecular formula C23H25NO5S and molecular weight 427.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[[4-(4-methylphenyl)-3-propan-2-yloxycarbonylthiophen-2-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid
Also Known As: 6-({[3-(isopropoxycarbonyl)-4-(4-methylphenyl)thien-2-yl]amino}carbonyl)cyclohex-3-ene-1-carboxylic acid, 6-((3-(isopropoxycarbonyl)-4-(p-tolyl)thiophen-2-yl)carbamoyl)cyclohex-3-enecarboxylic acid, 3-thiophenecarboxylic acid, 2-[[(6-carboxy-3-cyclohexen-1-yl)carbonyl]amino]-4-(4-methylphenyl)-, 3-(1-methylethyl) ester, 6-({4-(4-methylphenyl)-3-[(propan-2-yloxy)carbonyl]thiophen-2-yl}carbamoyl)cyclohex-3-ene-1-carboxylic acid, 6-[[4-(4-methylphenyl)-3-propan-2-yloxycarbonylthiophen-2-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid
| Molecular Formula | C23H25NO5S |
|---|---|
| Molecular Weight | 427.15 g/mol |
| LogP | 4.89422 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 427.14536 |
| Heavy Atoms | 30 |
| Complexity | 973.97974 |
Chemical Identifiers
| CAS Number | 351000-50-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC(C)C)NC(=O)C3CC=CCC3C(=O)O |
Product Overview
6-({[3-(isopropoxycarbonyl)-4-(4-methylphenyl)thien-2-yl]amino}carbonyl)cyclohex-3-ene-1-carboxylic acid (CAS 351000-50-5), with molecular formula C23H25NO5S and molecular weight 427.15 g/mol. IUPAC: 6-[[4-(4-methylphenyl)-3-propan-2-yloxycarbonylthiophen-2-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid.
Chemical Property Profile of 6-({[3-(isopropoxycarbonyl)-4-(4-methylphenyl)thien-2-yl]amino}carbonyl)cyclohex-3-ene-1-carboxylic acid
Property Insights of 6-({[3-(isopropoxycarbonyl)-4-(4-methylphenyl)thien-2-yl]amino}carbonyl)cyclohex-3-ene-1-carboxylic acid
The XLogP value of 4.89422 indicates that 6-({[3-(isopropoxycarbonyl)-4-(4-methylphenyl)thien-2-yl]amino}carbonyl)cyclohex-3-ene-1-carboxylic 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 6-({[3-(isopropoxycarbonyl)-4-(4-methylphenyl)thien-2-yl]amino}carbonyl)cyclohex-3-ene-1-carboxylic acid. Following Lipinski's Rule of Five, 6-({[3-(isopropoxycarbonyl)-4-(4-methylphenyl)thien-2-yl]amino}carbonyl)cyclohex-3-ene-1-carboxylic 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 6-({[3-(isopropoxycarbonyl)-4-(4-methylphenyl)thien-2-yl]amino}carbonyl)cyclohex-3-ene-1-carboxylic acid?
The CAS number of 6-({[3-(isopropoxycarbonyl)-4-(4-methylphenyl)thien-2-yl]amino}carbonyl)cyclohex-3-ene-1-carboxylic acid is 351000-50-5.
What is the molecular formula of 6-({[3-(isopropoxycarbonyl)-4-(4-methylphenyl)thien-2-yl]amino}carbonyl)cyclohex-3-ene-1-carboxylic acid?
The molecular formula of 6-({[3-(isopropoxycarbonyl)-4-(4-methylphenyl)thien-2-yl]amino}carbonyl)cyclohex-3-ene-1-carboxylic acid is C23H25NO5S.
What is the molecular weight of 6-({[3-(isopropoxycarbonyl)-4-(4-methylphenyl)thien-2-yl]amino}carbonyl)cyclohex-3-ene-1-carboxylic acid?
The molecular weight of 6-({[3-(isopropoxycarbonyl)-4-(4-methylphenyl)thien-2-yl]amino}carbonyl)cyclohex-3-ene-1-carboxylic acid is 427.15 g/mol.
Where can I buy 6-({[3-(isopropoxycarbonyl)-4-(4-methylphenyl)thien-2-yl]amino}carbonyl)cyclohex-3-ene-1-carboxylic acid?
You can request a quote for 6-({[3-(isopropoxycarbonyl)-4-(4-methylphenyl)thien-2-yl]amino}carbonyl)cyclohex-3-ene-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-({[3-(isopropoxycarbonyl)-4-(4-methylphenyl)thien-2-yl]amino}carbonyl)cyclohex-3-ene-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-({[3-(isopropoxycarbonyl)-4-(4-methylphenyl)thien-2-yl]amino}carbonyl)cyclohex-3-ene-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.