3,3'-Dicyclohexyl-1,1'-methylenebis(4,1-phenylene)diurea
TL;DR: 3,3'-Dicyclohexyl-1,1'-methylenebis(4,1-phenylene)diurea (CAS 58890-25-8) is a chemical compound with molecular formula C27H36N4O2 and molecular weight 448.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyclohexyl-3-[4-[[4-(cyclohexylcarbamoylamino)phenyl]methyl]phenyl]urea
Also Known As: N,N''- bisN'-cyclohexyl-Urea, 3,3'-Dicyclohexyl-1,1'-methylenebis(4,1-phenylene)diurea, EX-A7249, EC 406-370-3, 1-cyclohexyl-3-[4-[[4-(cyclohexylcarbamoylamino)phenyl]methyl]phenyl]urea
| Molecular Formula | C27H36N4O2 |
|---|---|
| Molecular Weight | 448.28 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 82.3 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 448.2838 |
| Heavy Atoms | 33 |
| Complexity | 547.0 |
Chemical Identifiers
| CAS Number | 58890-25-8 |
|---|---|
| SMILES | C1CCC(CC1)NC(=O)NC2=CC=C(C=C2)CC3=CC=C(C=C3)NC(=O)NC4CCCCC4 |
| InChIKey | SGXPOLBQSKXTKY-UHFFFAOYSA-N |
Product Overview
3,3'-Dicyclohexyl-1,1'-methylenebis(4,1-phenylene)diurea (CAS 58890-25-8), with molecular formula C27H36N4O2 and molecular weight 448.28 g/mol. IUPAC: 1-cyclohexyl-3-[4-[[4-(cyclohexylcarbamoylamino)phenyl]methyl]phenyl]urea.
Chemical Property Profile of 3,3'-Dicyclohexyl-1,1'-methylenebis(4,1-phenylene)diurea
Property Insights of 3,3'-Dicyclohexyl-1,1'-methylenebis(4,1-phenylene)diurea
The XLogP value of 5.5 indicates that 3,3'-Dicyclohexyl-1,1'-methylenebis(4,1-phenylene)diurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3'-Dicyclohexyl-1,1'-methylenebis(4,1-phenylene)diurea. Following Lipinski's Rule of Five, 3,3'-Dicyclohexyl-1,1'-methylenebis(4,1-phenylene)diurea has 4 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'-Dicyclohexyl-1,1'-methylenebis(4,1-phenylene)diurea?
The CAS number of 3,3'-Dicyclohexyl-1,1'-methylenebis(4,1-phenylene)diurea is 58890-25-8.
What is the molecular formula of 3,3'-Dicyclohexyl-1,1'-methylenebis(4,1-phenylene)diurea?
The molecular formula of 3,3'-Dicyclohexyl-1,1'-methylenebis(4,1-phenylene)diurea is C27H36N4O2.
What is the molecular weight of 3,3'-Dicyclohexyl-1,1'-methylenebis(4,1-phenylene)diurea?
The molecular weight of 3,3'-Dicyclohexyl-1,1'-methylenebis(4,1-phenylene)diurea is 448.28 g/mol.
Where can I buy 3,3'-Dicyclohexyl-1,1'-methylenebis(4,1-phenylene)diurea?
You can request a quote for 3,3'-Dicyclohexyl-1,1'-methylenebis(4,1-phenylene)diurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-Dicyclohexyl-1,1'-methylenebis(4,1-phenylene)diurea?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-Dicyclohexyl-1,1'-methylenebis(4,1-phenylene)diurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.