Urea, ((dimethylamino)(methylamino)methylene)(2,6-dimethylphenyl)-, monohydrochloride
TL;DR: Urea, ((dimethylamino)(methylamino)methylene)(2,6-dimethylphenyl)-, monohydrochloride (CAS 66871-37-2) 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.
1-(2,6-dimethylphenyl)-3-(N,N,N'-trimethylcarbamimidoyl)urea;hydrochloride
Also Known As: Urea, ((dimethylamino)(methylamino)methylene)(2,6-dimethylphenyl)-, monohydrochloride, ((Dimethylamino)(methylamino)methylene)(2,6-dimethylphenyl)urea hydrochloride, 1-(2,6-dimethylphenyl)-3-(N,N,N'-trimethylcarbamimidoyl)urea hydrochloride, N-(2,6-Dimethylphenyl)-N'-(N,N,N'-trimethylcarbamimidoyl)urea--hydrogen chloride (1/1), RefChem:387065
| Molecular Formula | C13H21ClN4O |
|---|---|
| Molecular Weight | 284.14 g/mol |
| LogP | 2.39414 |
| Topological Polar Surface Area | 56.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 284.14038 |
| Heavy Atoms | 19 |
| Complexity | 451.46106 |
Chemical Identifiers
| CAS Number | 66871-37-2 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)NC(=O)NC(=NC)N(C)C.Cl |
Product Overview
Urea, ((dimethylamino)(methylamino)methylene)(2,6-dimethylphenyl)-, monohydrochloride (CAS 66871-37-2), with molecular formula C13H21ClN4O and molecular weight 284.14 g/mol. IUPAC: 1-(2,6-dimethylphenyl)-3-(N,N,N'-trimethylcarbamimidoyl)urea;hydrochloride.
Chemical Property Profile of Urea, ((dimethylamino)(methylamino)methylene)(2,6-dimethylphenyl)-, monohydrochloride
Property Insights of Urea, ((dimethylamino)(methylamino)methylene)(2,6-dimethylphenyl)-, monohydrochloride
The XLogP value of 2.39414 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, ((dimethylamino)(methylamino)methylene)(2,6-dimethylphenyl)-, monohydrochloride. With a topological polar surface area (TPSA) of 56.73 Ų, Urea, ((dimethylamino)(methylamino)methylene)(2,6-dimethylphenyl)-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Urea, ((dimethylamino)(methylamino)methylene)(2,6-dimethylphenyl)-, monohydrochloride 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 Urea, ((dimethylamino)(methylamino)methylene)(2,6-dimethylphenyl)-, monohydrochloride?
The CAS number of Urea, ((dimethylamino)(methylamino)methylene)(2,6-dimethylphenyl)-, monohydrochloride is 66871-37-2.
What is the molecular formula of Urea, ((dimethylamino)(methylamino)methylene)(2,6-dimethylphenyl)-, monohydrochloride?
The molecular formula of Urea, ((dimethylamino)(methylamino)methylene)(2,6-dimethylphenyl)-, monohydrochloride is C13H21ClN4O.
What is the molecular weight of Urea, ((dimethylamino)(methylamino)methylene)(2,6-dimethylphenyl)-, monohydrochloride?
The molecular weight of Urea, ((dimethylamino)(methylamino)methylene)(2,6-dimethylphenyl)-, monohydrochloride is 284.14 g/mol.
Where can I buy Urea, ((dimethylamino)(methylamino)methylene)(2,6-dimethylphenyl)-, monohydrochloride?
You can request a quote for Urea, ((dimethylamino)(methylamino)methylene)(2,6-dimethylphenyl)-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, ((dimethylamino)(methylamino)methylene)(2,6-dimethylphenyl)-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Urea, ((dimethylamino)(methylamino)methylene)(2,6-dimethylphenyl)-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.