Urea, N'-(aminoiminomethyl)-N-(2,6-diethylphenyl)-N-methyl-, monohydrochloride
TL;DR: Urea, N'-(aminoiminomethyl)-N-(2,6-diethylphenyl)-N-methyl-, monohydrochloride (CAS 68656-71-3) is a chemical compound with molecular formula C13H21ClN4O and molecular weight 284.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(diaminomethylidene)-1-(2,6-diethylphenyl)-1-methylurea;hydrochloride
Also Known As: Urea, 3-amidino-1-(2,6-diethylphenyl)-1-methyl-, hydrochloride, 3-Amidino-1-(2,6-diethylphenyl)-1-methyl-urea hydrochloride, Urea, N'-(aminoiminomethyl)-N-(2,6-diethylphenyl)-N-methyl-, monohydrochloride, N'-(Aminoiminomethyl)-N-(2,6-diethylphenyl)-N-methylurea hydrochloride, 3-(diaminomethylidene)-1-(2,6-diethylphenyl)-1-methylurea hydrochloride
| Molecular Formula | C13H21ClN4O |
|---|---|
| Molecular Weight | 284.14 g/mol |
| LogP | 2.0628 |
| Topological Polar Surface Area | 84.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 284.14038 |
| Heavy Atoms | 19 |
| Complexity | 447.46106 |
Chemical Identifiers
| CAS Number | 68656-71-3 |
|---|---|
| SMILES | CCC1=C(C(=CC=C1)CC)N(C)C(=O)N=C(N)N.Cl |
Product Overview
Urea, N'-(aminoiminomethyl)-N-(2,6-diethylphenyl)-N-methyl-, monohydrochloride (CAS 68656-71-3), with molecular formula C13H21ClN4O and molecular weight 284.14 g/mol. IUPAC: 3-(diaminomethylidene)-1-(2,6-diethylphenyl)-1-methylurea;hydrochloride.
Chemical Property Profile of Urea, N'-(aminoiminomethyl)-N-(2,6-diethylphenyl)-N-methyl-, monohydrochloride
Property Insights of Urea, N'-(aminoiminomethyl)-N-(2,6-diethylphenyl)-N-methyl-, monohydrochloride
The XLogP value of 2.0628 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, N'-(aminoiminomethyl)-N-(2,6-diethylphenyl)-N-methyl-, monohydrochloride. The TPSA of 84.71 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, N'-(aminoiminomethyl)-N-(2,6-diethylphenyl)-N-methyl-, monohydrochloride. Following Lipinski's Rule of Five, Urea, N'-(aminoiminomethyl)-N-(2,6-diethylphenyl)-N-methyl-, monohydrochloride has 2 hydrogen bond donor(s) and 1 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 Urea, N'-(aminoiminomethyl)-N-(2,6-diethylphenyl)-N-methyl-, monohydrochloride?
The CAS number of Urea, N'-(aminoiminomethyl)-N-(2,6-diethylphenyl)-N-methyl-, monohydrochloride is 68656-71-3.
What is the molecular formula of Urea, N'-(aminoiminomethyl)-N-(2,6-diethylphenyl)-N-methyl-, monohydrochloride?
The molecular formula of Urea, N'-(aminoiminomethyl)-N-(2,6-diethylphenyl)-N-methyl-, monohydrochloride is C13H21ClN4O.
What is the molecular weight of Urea, N'-(aminoiminomethyl)-N-(2,6-diethylphenyl)-N-methyl-, monohydrochloride?
The molecular weight of Urea, N'-(aminoiminomethyl)-N-(2,6-diethylphenyl)-N-methyl-, monohydrochloride is 284.14 g/mol.
Where can I buy Urea, N'-(aminoiminomethyl)-N-(2,6-diethylphenyl)-N-methyl-, monohydrochloride?
You can request a quote for Urea, N'-(aminoiminomethyl)-N-(2,6-diethylphenyl)-N-methyl-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, N'-(aminoiminomethyl)-N-(2,6-diethylphenyl)-N-methyl-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Urea, N'-(aminoiminomethyl)-N-(2,6-diethylphenyl)-N-methyl-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.