RefChem:387893
TL;DR: RefChem:387893 (CAS 68656-87-1) is a chemical compound with molecular formula C13H21ClN4O2 and molecular weight 300.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,6-dimethylphenyl)-3-[N'-(2-methoxyethyl)carbamimidoyl]urea;hydrochloride
Also Known As: Urea, 1-(2-methoxyethyl)amidino-3-(2,6-xylyl)-, hydrochloride, 1-(2-Methoxyethyl)amidino-3-(2,6-xylyl)-urea hydrochloride, Urea, N-(2,6-dimethylphenyl)-N'-(imino((2-methoxyethyl)amino)methyl)-, monohydrochloride, N-(2,6-Dimethylphenyl)-N'-(imino((2-methoxyethyl)amino)methyl)urea hydrochloride, 1-(2,6-dimethylphenyl)-3-[N'-(2-methoxyethyl)carbamimidoyl]urea hydrochloride
| Molecular Formula | C13H21ClN4O2 |
|---|---|
| Molecular Weight | 300.14 g/mol |
| LogP | 1.80784 |
| Topological Polar Surface Area | 88.74 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 300.1353 |
| Heavy Atoms | 20 |
| Complexity | 457.189 |
Chemical Identifiers
| CAS Number | 68656-87-1 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)NC(=O)NC(=NCCOC)N.Cl |
Product Overview
RefChem:387893 (CAS 68656-87-1), with molecular formula C13H21ClN4O2 and molecular weight 300.14 g/mol. IUPAC: 1-(2,6-dimethylphenyl)-3-[N'-(2-methoxyethyl)carbamimidoyl]urea;hydrochloride.
Chemical Property Profile of RefChem:387893
Property Insights of RefChem:387893
The XLogP value of 1.80784 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:387893. The TPSA of 88.74 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:387893. Following Lipinski's Rule of Five, RefChem:387893 has 3 hydrogen bond donor(s) and 3 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 RefChem:387893?
The CAS number of RefChem:387893 is 68656-87-1.
What is the molecular formula of RefChem:387893?
The molecular formula of RefChem:387893 is C13H21ClN4O2.
What is the molecular weight of RefChem:387893?
The molecular weight of RefChem:387893 is 300.14 g/mol.
Where can I buy RefChem:387893?
You can request a quote for RefChem:387893 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:387893?
Yes, KEHONG BIO provides custom synthesis services for RefChem:387893 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.