Urea, N-(aminoiminomethyl)-N'-(2-methylphenyl)-, monohydrochloride
TL;DR: Urea, N-(aminoiminomethyl)-N'-(2-methylphenyl)-, monohydrochloride (CAS 68657-19-2) is a chemical compound with molecular formula C9H13ClN4O and molecular weight 228.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(diaminomethylidene)-3-(2-methylphenyl)urea;hydrochloride
Also Known As: Urea, 1-amidino-3-(o-tolyl)-, hydrochloride, Urea, N-(aminoiminomethyl)-N'-(2-methylphenyl)-, monohydrochloride, N-(Aminoiminomethyl)-N'-(2-methylphenyl)-urea hydrochloride, 1-(diaminomethylidene)-3-(2-methylphenyl)urea hydrochloride, 1-(diaminomethylidene)-3-(2-methylphenyl)urea,hydrochloride
| Molecular Formula | C9H13ClN4O |
|---|---|
| Molecular Weight | 228.08 g/mol |
| LogP | 1.22212 |
| Topological Polar Surface Area | 93.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 228.07779 |
| Heavy Atoms | 15 |
| Complexity | 374.13004 |
Chemical Identifiers
| CAS Number | 68657-19-2 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)N=C(N)N.Cl |
Product Overview
Urea, N-(aminoiminomethyl)-N'-(2-methylphenyl)-, monohydrochloride (CAS 68657-19-2), with molecular formula C9H13ClN4O and molecular weight 228.08 g/mol. IUPAC: 1-(diaminomethylidene)-3-(2-methylphenyl)urea;hydrochloride.
Chemical Property Profile of Urea, N-(aminoiminomethyl)-N'-(2-methylphenyl)-, monohydrochloride
Property Insights of Urea, N-(aminoiminomethyl)-N'-(2-methylphenyl)-, monohydrochloride
The XLogP value of 1.22212 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, N-(aminoiminomethyl)-N'-(2-methylphenyl)-, monohydrochloride. The TPSA of 93.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, N-(aminoiminomethyl)-N'-(2-methylphenyl)-, monohydrochloride. Following Lipinski's Rule of Five, Urea, N-(aminoiminomethyl)-N'-(2-methylphenyl)-, monohydrochloride has 3 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-methylphenyl)-, monohydrochloride?
The CAS number of Urea, N-(aminoiminomethyl)-N'-(2-methylphenyl)-, monohydrochloride is 68657-19-2.
What is the molecular formula of Urea, N-(aminoiminomethyl)-N'-(2-methylphenyl)-, monohydrochloride?
The molecular formula of Urea, N-(aminoiminomethyl)-N'-(2-methylphenyl)-, monohydrochloride is C9H13ClN4O.
What is the molecular weight of Urea, N-(aminoiminomethyl)-N'-(2-methylphenyl)-, monohydrochloride?
The molecular weight of Urea, N-(aminoiminomethyl)-N'-(2-methylphenyl)-, monohydrochloride is 228.08 g/mol.
Where can I buy Urea, N-(aminoiminomethyl)-N'-(2-methylphenyl)-, monohydrochloride?
You can request a quote for Urea, N-(aminoiminomethyl)-N'-(2-methylphenyl)-, 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-methylphenyl)-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Urea, N-(aminoiminomethyl)-N'-(2-methylphenyl)-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.