3,3'-Hexamethylenebis(1,1-dibutylurea)
TL;DR: 3,3'-Hexamethylenebis(1,1-dibutylurea) (CAS 54772-39-3) is a chemical compound with molecular formula C24H50N4O2 and molecular weight 426.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-dibutyl-3-[6-(dibutylcarbamoylamino)hexyl]urea
Also Known As: Hexamethylendibutylurea, 3,3'-HEXAMETHYLENEBIS(1,1-DIBUTYLUREA), 1,1-dibutyl-3-[6-(dibutylcarbamoylamino)hexyl]urea, J2.776.643I, 3,3-dibutyl-1-{6-[(dibutylcarbamoyl)amino]hexyl}urea
| Molecular Formula | C24H50N4O2 |
|---|---|
| Molecular Weight | 426.39 g/mol |
| LogP | 5.7704 |
| Topological Polar Surface Area | 64.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 19 |
| Exact Mass | 426.39337 |
| Heavy Atoms | 30 |
| Complexity | 364.0101 |
Chemical Identifiers
| CAS Number | 54772-39-3 |
|---|---|
| SMILES | CCCCN(CCCC)C(=O)NCCCCCCNC(=O)N(CCCC)CCCC |
Product Overview
3,3'-Hexamethylenebis(1,1-dibutylurea) (CAS 54772-39-3), with molecular formula C24H50N4O2 and molecular weight 426.39 g/mol. IUPAC: 1,1-dibutyl-3-[6-(dibutylcarbamoylamino)hexyl]urea.
Chemical Property Profile of 3,3'-Hexamethylenebis(1,1-dibutylurea)
Property Insights of 3,3'-Hexamethylenebis(1,1-dibutylurea)
The XLogP value of 5.7704 indicates that 3,3'-Hexamethylenebis(1,1-dibutylurea) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3'-Hexamethylenebis(1,1-dibutylurea). Following Lipinski's Rule of Five, 3,3'-Hexamethylenebis(1,1-dibutylurea) has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,3'-Hexamethylenebis(1,1-dibutylurea)?
The CAS number of 3,3'-Hexamethylenebis(1,1-dibutylurea) is 54772-39-3.
What is the molecular formula of 3,3'-Hexamethylenebis(1,1-dibutylurea)?
The molecular formula of 3,3'-Hexamethylenebis(1,1-dibutylurea) is C24H50N4O2.
What is the molecular weight of 3,3'-Hexamethylenebis(1,1-dibutylurea)?
The molecular weight of 3,3'-Hexamethylenebis(1,1-dibutylurea) is 426.39 g/mol.
Where can I buy 3,3'-Hexamethylenebis(1,1-dibutylurea)?
You can request a quote for 3,3'-Hexamethylenebis(1,1-dibutylurea) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-Hexamethylenebis(1,1-dibutylurea)?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-Hexamethylenebis(1,1-dibutylurea) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.