2-(Cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoic acid
TL;DR: 2-(Cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoic acid (CAS 329703-25-5) is a chemical compound with molecular formula C22H31NO3 and molecular weight 357.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoic acid
Also Known As: TimTec1_005277, 2-(cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoic acid, 2-(cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoicacid, 2-(cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxo-butanoic acid
| Molecular Formula | C22H31NO3 |
|---|---|
| Molecular Weight | 357.23 g/mol |
| LogP | 4.6826 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 357.2304 |
| Heavy Atoms | 26 |
| Complexity | 598.3183 |
Chemical Identifiers
| CAS Number | 329703-25-5 |
|---|---|
| SMILES | C1CCC(CC1)C2=CC=C(C=C2)C(=O)CC(C(=O)O)NC3CCCCC3 |
Product Overview
2-(Cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoic acid (CAS 329703-25-5), with molecular formula C22H31NO3 and molecular weight 357.23 g/mol. IUPAC: 2-(cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoic acid.
Chemical Property Profile of 2-(Cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoic acid
Property Insights of 2-(Cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoic acid
The XLogP value of 4.6826 indicates that 2-(Cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoic acid. Following Lipinski's Rule of Five, 2-(Cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoic acid has 2 hydrogen bond donor(s) and 3 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-(Cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoic acid?
The CAS number of 2-(Cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoic acid is 329703-25-5.
What is the molecular formula of 2-(Cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoic acid?
The molecular formula of 2-(Cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoic acid is C22H31NO3.
What is the molecular weight of 2-(Cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoic acid?
The molecular weight of 2-(Cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoic acid is 357.23 g/mol.
Where can I buy 2-(Cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoic acid?
You can request a quote for 2-(Cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(Cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.