3,3'-(4-Methyl-1,3-phenylene)bis(1,1-dibutylurea)
TL;DR: 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-dibutylurea) (CAS 63785-39-7) is a chemical compound with molecular formula C25H44N4O2 and molecular weight 432.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-dibutyl-3-[3-(dibutylcarbamoylamino)-4-methylphenyl]urea
Also Known As: 2,4-Bis(3,3-dibutylureido)toluene, 1,1-dibutyl-3-[3-(dibutylcarbamoylamino)-4-methylphenyl]urea, Urea, N,N''-(4-methyl-1,3-phenylene)bis[N',N'-dibutyl-, J2.194.699K, 3,3'-(4-METHYL-1,3-PHENYLENE)BIS(1,1-DIBUTYLUREA)
| Molecular Formula | C25H44N4O2 |
|---|---|
| Molecular Weight | 432.35 g/mol |
| LogP | 6.86322 |
| Topological Polar Surface Area | 64.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 14 |
| Exact Mass | 432.34644 |
| Heavy Atoms | 31 |
| Complexity | 646.9221 |
Chemical Identifiers
| CAS Number | 63785-39-7 |
|---|---|
| SMILES | CCCCN(CCCC)C(=O)NC1=CC(=C(C=C1)C)NC(=O)N(CCCC)CCCC |
Product Overview
3,3'-(4-Methyl-1,3-phenylene)bis(1,1-dibutylurea) (CAS 63785-39-7), with molecular formula C25H44N4O2 and molecular weight 432.35 g/mol. IUPAC: 1,1-dibutyl-3-[3-(dibutylcarbamoylamino)-4-methylphenyl]urea.
Chemical Property Profile of 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-dibutylurea)
Property Insights of 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-dibutylurea)
The XLogP value of 6.86322 indicates that 3,3'-(4-Methyl-1,3-phenylene)bis(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'-(4-Methyl-1,3-phenylene)bis(1,1-dibutylurea). Following Lipinski's Rule of Five, 3,3'-(4-Methyl-1,3-phenylene)bis(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'-(4-Methyl-1,3-phenylene)bis(1,1-dibutylurea)?
The CAS number of 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-dibutylurea) is 63785-39-7.
What is the molecular formula of 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-dibutylurea)?
The molecular formula of 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-dibutylurea) is C25H44N4O2.
What is the molecular weight of 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-dibutylurea)?
The molecular weight of 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-dibutylurea) is 432.35 g/mol.
Where can I buy 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-dibutylurea)?
You can request a quote for 3,3'-(4-Methyl-1,3-phenylene)bis(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'-(4-Methyl-1,3-phenylene)bis(1,1-dibutylurea)?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-dibutylurea) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.