3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diethylurea)
TL;DR: 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diethylurea) (CAS 20718-10-9) is a chemical compound with molecular formula C17H28N4O2 and molecular weight 320.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(diethylcarbamoylamino)-4-methylphenyl]-1,1-diethylurea
Also Known As: 3-[3-(diethylcarbamoylamino)-4-methylphenyl]-1,1-diethylurea, Urea, N,N''-(4-methyl-1,3-phenylene)bis[N',N'-diethyl-, 3,3'-(4-METHYL-1,3-PHENYLENE)BIS(1,1-DIETHYLUREA), 1-{5-[(diethylcarbamoyl)amino]-2-methylphenyl}-3,3-diethylurea, N',N''-(4-Methyl-1,3-phenylene)bis(N,N-diethylurea)
| Molecular Formula | C17H28N4O2 |
|---|---|
| Molecular Weight | 320.22 g/mol |
| LogP | 3.74242 |
| Topological Polar Surface Area | 64.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 320.22122 |
| Heavy Atoms | 23 |
| Complexity | 537.39496 |
Chemical Identifiers
| CAS Number | 20718-10-9 |
|---|---|
| SMILES | CCN(CC)C(=O)NC1=CC(=C(C=C1)C)NC(=O)N(CC)CC |
Product Overview
3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diethylurea) (CAS 20718-10-9), with molecular formula C17H28N4O2 and molecular weight 320.22 g/mol. IUPAC: 3-[3-(diethylcarbamoylamino)-4-methylphenyl]-1,1-diethylurea.
Chemical Property Profile of 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diethylurea)
Property Insights of 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diethylurea)
The XLogP value of 3.74242 indicates that 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diethylurea) 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-diethylurea). Following Lipinski's Rule of Five, 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diethylurea) has 2 hydrogen bond donor(s) and 2 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 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diethylurea)?
The CAS number of 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diethylurea) is 20718-10-9.
What is the molecular formula of 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diethylurea)?
The molecular formula of 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diethylurea) is C17H28N4O2.
What is the molecular weight of 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diethylurea)?
The molecular weight of 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diethylurea) is 320.22 g/mol.
Where can I buy 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diethylurea)?
You can request a quote for 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diethylurea) 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-diethylurea)?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diethylurea) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.