2-Diisobutylcarbamoyl-cyclohexanecarboxylic acid
TL;DR: 2-Diisobutylcarbamoyl-cyclohexanecarboxylic acid (CAS 332394-38-4) is a chemical compound with molecular formula C16H29NO3 and molecular weight 283.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis(2-methylpropyl)carbamoyl]cyclohexane-1-carboxylic acid
Also Known As: PHOSPHORUSTRIIODIDE, 2-Diisobutylcarbamoyl-cyclohexanecarboxylic acid, 2-(diisobutylcarbamoyl)cyclohexanecarboxylic acid, TIMTEC-BB SBB012239, 2-[bis(2-methylpropyl)carbamoyl]cyclohexane-1-carboxylic acid
| Molecular Formula | C16H29NO3 |
|---|---|
| Molecular Weight | 283.21 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 283.21475 |
| Heavy Atoms | 20 |
| Complexity | 329.0 |
Chemical Identifiers
| CAS Number | 332394-38-4 |
|---|---|
| SMILES | CC(C)CN(CC(C)C)C(=O)C1CCCCC1C(=O)O |
| InChIKey | JVPOLLYQYUEDLO-UHFFFAOYSA-N |
Product Overview
2-Diisobutylcarbamoyl-cyclohexanecarboxylic acid (CAS 332394-38-4), with molecular formula C16H29NO3 and molecular weight 283.21 g/mol. IUPAC: 2-[bis(2-methylpropyl)carbamoyl]cyclohexane-1-carboxylic acid.
Chemical Property Profile of 2-Diisobutylcarbamoyl-cyclohexanecarboxylic acid
Property Insights of 2-Diisobutylcarbamoyl-cyclohexanecarboxylic acid
The XLogP value of 3.5 indicates that 2-Diisobutylcarbamoyl-cyclohexanecarboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.6 Ų, 2-Diisobutylcarbamoyl-cyclohexanecarboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Diisobutylcarbamoyl-cyclohexanecarboxylic acid has 1 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-Diisobutylcarbamoyl-cyclohexanecarboxylic acid?
The CAS number of 2-Diisobutylcarbamoyl-cyclohexanecarboxylic acid is 332394-38-4.
What is the molecular formula of 2-Diisobutylcarbamoyl-cyclohexanecarboxylic acid?
The molecular formula of 2-Diisobutylcarbamoyl-cyclohexanecarboxylic acid is C16H29NO3.
What is the molecular weight of 2-Diisobutylcarbamoyl-cyclohexanecarboxylic acid?
The molecular weight of 2-Diisobutylcarbamoyl-cyclohexanecarboxylic acid is 283.21 g/mol.
Where can I buy 2-Diisobutylcarbamoyl-cyclohexanecarboxylic acid?
You can request a quote for 2-Diisobutylcarbamoyl-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-Diisobutylcarbamoyl-cyclohexanecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Diisobutylcarbamoyl-cyclohexanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.