Urea, N,N''-(methyl-1,3-phenylene)bis[N'-(1-methyltetradecyl)-
TL;DR: Urea, N,N''-(methyl-1,3-phenylene)bis[N'-(1-methyltetradecyl)- (CAS 67892-53-9) is a chemical compound with molecular formula C39H72N4O2 and molecular weight 628.57 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-methyl-3-(pentadecan-2-ylcarbamoylamino)phenyl]-3-pentadecan-2-ylurea
Also Known As: N,N''- bis[N'- urea], Toluene diisocyanate adduct of alpha-methyltetradecylamine, Urea, N,N''-(methyl-1,3-phenylene)bis(N'-(1-methyltetradecyl)-, Urea, N,N''-(methyl-1,3-phenylene)bis[N'-(1-methyltetradecyl)-, N,N''-(Methyl-m-phenylene)bis(N'-(1-methyltetradecyl)urea)
| Molecular Formula | C39H72N4O2 |
|---|---|
| Molecular Weight | 628.57 g/mol |
| LogP | 14.5 |
| Topological Polar Surface Area | 82.3 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 28 |
| Exact Mass | 628.56555 |
| Heavy Atoms | 45 |
| Complexity | 647.0 |
Chemical Identifiers
| CAS Number | 67892-53-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCC(C)NC(=O)NC1=C(C(=CC=C1)NC(=O)NC(C)CCCCCCCCCCCCC)C |
| InChIKey | FXELAOIQWZLGSE-UHFFFAOYSA-N |
Product Overview
Urea, N,N''-(methyl-1,3-phenylene)bis[N'-(1-methyltetradecyl)- (CAS 67892-53-9), with molecular formula C39H72N4O2 and molecular weight 628.57 g/mol. IUPAC: 1-[2-methyl-3-(pentadecan-2-ylcarbamoylamino)phenyl]-3-pentadecan-2-ylurea.
Chemical Property Profile of Urea, N,N''-(methyl-1,3-phenylene)bis[N'-(1-methyltetradecyl)-
Property Insights of Urea, N,N''-(methyl-1,3-phenylene)bis[N'-(1-methyltetradecyl)-
The XLogP value of 14.5 indicates that Urea, N,N''-(methyl-1,3-phenylene)bis[N'-(1-methyltetradecyl)- 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 Urea, N,N''-(methyl-1,3-phenylene)bis[N'-(1-methyltetradecyl)-. Following Lipinski's Rule of Five, Urea, N,N''-(methyl-1,3-phenylene)bis[N'-(1-methyltetradecyl)- 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 Urea, N,N''-(methyl-1,3-phenylene)bis[N'-(1-methyltetradecyl)-?
The CAS number of Urea, N,N''-(methyl-1,3-phenylene)bis[N'-(1-methyltetradecyl)- is 67892-53-9.
What is the molecular formula of Urea, N,N''-(methyl-1,3-phenylene)bis[N'-(1-methyltetradecyl)-?
The molecular formula of Urea, N,N''-(methyl-1,3-phenylene)bis[N'-(1-methyltetradecyl)- is C39H72N4O2.
What is the molecular weight of Urea, N,N''-(methyl-1,3-phenylene)bis[N'-(1-methyltetradecyl)-?
The molecular weight of Urea, N,N''-(methyl-1,3-phenylene)bis[N'-(1-methyltetradecyl)- is 628.57 g/mol.
Where can I buy Urea, N,N''-(methyl-1,3-phenylene)bis[N'-(1-methyltetradecyl)-?
You can request a quote for Urea, N,N''-(methyl-1,3-phenylene)bis[N'-(1-methyltetradecyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, N,N''-(methyl-1,3-phenylene)bis[N'-(1-methyltetradecyl)-?
Yes, KEHONG BIO provides custom synthesis services for Urea, N,N''-(methyl-1,3-phenylene)bis[N'-(1-methyltetradecyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.