Guanidine, 1-(p-allyloxyphenyl)-3-(p-chlorophenethyl)-2-(p-tolyl)-, hydrobromide
TL;DR: Guanidine, 1-(p-allyloxyphenyl)-3-(p-chlorophenethyl)-2-(p-tolyl)-, hydrobromide (CAS 69415-44-7) is a chemical compound with molecular formula C25H27BrClN3O and molecular weight 499.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[N'-[2-(4-chlorophenyl)ethyl]-N-(4-methylphenyl)carbamimidoyl]-(4-prop-2-enoxyphenyl)azanium bromide
Also Known As: 1-(p-Allyloxyphenyl)-3-(p-chlorophenethyl)-2-(p-tolyl)guanidine hydrobromide, N-p-Tolyl-N'-(p-allyloxyphenyl)-N''-(p-chlorophenethyl) guanidine hydrobromide, GUANIDINE, 1-(p-ALLYLOXYPHENYL)-3-(p-CHLOROPHENETHYL)-2-(p-TOLYL)-, HYDROBROMIDE, [N'-[2-(4-chlorophenyl)ethyl]-N-(4-methylphenyl)carbamimidoyl]-(4-prop-2-enoxyphenyl)azanium bromide, RefChem:346859
| Molecular Formula | C25H27BrClN3O |
|---|---|
| Molecular Weight | 499.10 g/mol |
| LogP | 2.12 |
| Topological Polar Surface Area | 50.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 499.1026 |
| Heavy Atoms | 31 |
| Complexity | 516.0 |
Chemical Identifiers
| CAS Number | 69415-44-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=NCCC2=CC=C(C=C2)Cl)[NH2+]C3=CC=C(C=C3)OCC=C.[Br-] |
| InChIKey | ZDFUMENTYGNSCS-UHFFFAOYSA-N |
Product Overview
Guanidine, 1-(p-allyloxyphenyl)-3-(p-chlorophenethyl)-2-(p-tolyl)-, hydrobromide (CAS 69415-44-7), with molecular formula C25H27BrClN3O and molecular weight 499.10 g/mol. IUPAC: [N'-[2-(4-chlorophenyl)ethyl]-N-(4-methylphenyl)carbamimidoyl]-(4-prop-2-enoxyphenyl)azanium bromide.
Chemical Property Profile of Guanidine, 1-(p-allyloxyphenyl)-3-(p-chlorophenethyl)-2-(p-tolyl)-, hydrobromide
Property Insights of Guanidine, 1-(p-allyloxyphenyl)-3-(p-chlorophenethyl)-2-(p-tolyl)-, hydrobromide
The XLogP value of 2.12 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Guanidine, 1-(p-allyloxyphenyl)-3-(p-chlorophenethyl)-2-(p-tolyl)-, hydrobromide. With a topological polar surface area (TPSA) of 50.2 Ų, Guanidine, 1-(p-allyloxyphenyl)-3-(p-chlorophenethyl)-2-(p-tolyl)-, hydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Guanidine, 1-(p-allyloxyphenyl)-3-(p-chlorophenethyl)-2-(p-tolyl)-, hydrobromide has 2 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 Guanidine, 1-(p-allyloxyphenyl)-3-(p-chlorophenethyl)-2-(p-tolyl)-, hydrobromide?
The CAS number of Guanidine, 1-(p-allyloxyphenyl)-3-(p-chlorophenethyl)-2-(p-tolyl)-, hydrobromide is 69415-44-7.
What is the molecular formula of Guanidine, 1-(p-allyloxyphenyl)-3-(p-chlorophenethyl)-2-(p-tolyl)-, hydrobromide?
The molecular formula of Guanidine, 1-(p-allyloxyphenyl)-3-(p-chlorophenethyl)-2-(p-tolyl)-, hydrobromide is C25H27BrClN3O.
What is the molecular weight of Guanidine, 1-(p-allyloxyphenyl)-3-(p-chlorophenethyl)-2-(p-tolyl)-, hydrobromide?
The molecular weight of Guanidine, 1-(p-allyloxyphenyl)-3-(p-chlorophenethyl)-2-(p-tolyl)-, hydrobromide is 499.10 g/mol.
Where can I buy Guanidine, 1-(p-allyloxyphenyl)-3-(p-chlorophenethyl)-2-(p-tolyl)-, hydrobromide?
You can request a quote for Guanidine, 1-(p-allyloxyphenyl)-3-(p-chlorophenethyl)-2-(p-tolyl)-, hydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Guanidine, 1-(p-allyloxyphenyl)-3-(p-chlorophenethyl)-2-(p-tolyl)-, hydrobromide?
Yes, KEHONG BIO provides custom synthesis services for Guanidine, 1-(p-allyloxyphenyl)-3-(p-chlorophenethyl)-2-(p-tolyl)-, hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.