1-Tert-butyl-3-cyclohexylurea
TL;DR: 1-Tert-butyl-3-cyclohexylurea (CAS 54088-56-1) is a chemical compound with molecular formula C11H22N2O and molecular weight 198.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-tert-butyl-3-cyclohexylurea
Also Known As: 1-tert-butyl-3-cyclohexylurea, 3-tert-butyl-1-cyclohexylurea, N-(tert-butyl)-N'-cyclohexylurea, 1-Cyclohexyl-3-tert-butylurea, N-tert-Butyl-N'-cyclohexylurea
| Molecular Formula | C11H22N2O |
|---|---|
| Molecular Weight | 198.17 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 198.17322 |
| Heavy Atoms | 14 |
| Complexity | 190.0 |
Chemical Identifiers
| CAS Number | 54088-56-1 |
|---|---|
| SMILES | CC(C)(C)NC(=O)NC1CCCCC1 |
| InChIKey | COLUTWBYJCLQKO-UHFFFAOYSA-N |
Product Overview
1-Tert-butyl-3-cyclohexylurea (CAS 54088-56-1), with molecular formula C11H22N2O and molecular weight 198.17 g/mol. IUPAC: 1-tert-butyl-3-cyclohexylurea.
Chemical Property Profile of 1-Tert-butyl-3-cyclohexylurea
Property Insights of 1-Tert-butyl-3-cyclohexylurea
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Tert-butyl-3-cyclohexylurea. With a topological polar surface area (TPSA) of 41.1 Ų, 1-Tert-butyl-3-cyclohexylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Tert-butyl-3-cyclohexylurea has 2 hydrogen bond donor(s) and 1 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 1-Tert-butyl-3-cyclohexylurea?
The CAS number of 1-Tert-butyl-3-cyclohexylurea is 54088-56-1.
What is the molecular formula of 1-Tert-butyl-3-cyclohexylurea?
The molecular formula of 1-Tert-butyl-3-cyclohexylurea is C11H22N2O.
What is the molecular weight of 1-Tert-butyl-3-cyclohexylurea?
The molecular weight of 1-Tert-butyl-3-cyclohexylurea is 198.17 g/mol.
Where can I buy 1-Tert-butyl-3-cyclohexylurea?
You can request a quote for 1-Tert-butyl-3-cyclohexylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Tert-butyl-3-cyclohexylurea?
Yes, KEHONG BIO provides custom synthesis services for 1-Tert-butyl-3-cyclohexylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.