RefChem:315156
TL;DR: RefChem:315156 (CAS 86746-07-8) is a chemical compound with molecular formula C22H27Cl4N3O2 and molecular weight 505.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-[4-(2-methylphenyl)piperazin-1-ium-1-yl]propyl]-2-(2,4,5-trichlorophenoxy)acetamide chloride
Also Known As: Acetamide, N-(3-(4-(2-methylphenyl)-1-piperazinyl)propyl)-2-(2,4,5-trichlorophenoxy)-, monohydrochloride, N-(3-(4-(2-Methylphenyl)-1-piperazinyl)propyl)-2-(2,4,5-trichlorophenoxy)acetamide HCl, ACETAMIDE, N-(3-(4-(2-METHYLPHENYL)-1-PIPERAZINYL)PROPYL)-2-(2,4,5-TRICHLOROPHEN, N-[3-[4-(2-methylphenyl)piperazin-1-ium-1-yl]propyl]-2-(2,4,5-trichlorophenoxy)acetamide chloride
| Molecular Formula | C22H27Cl4N3O2 |
|---|---|
| Molecular Weight | 505.09 g/mol |
| LogP | 0.25 |
| Topological Polar Surface Area | 46.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 507.0828 |
| Heavy Atoms | 31 |
| Complexity | 534.0 |
Chemical Identifiers
| CAS Number | 86746-07-8 |
|---|---|
| SMILES | CC1=CC=CC=C1N2CC[NH+](CC2)CCCNC(=O)COC3=CC(=C(C=C3Cl)Cl)Cl.[Cl-] |
| InChIKey | DWFVJDGWCQHEAO-UHFFFAOYSA-N |
Product Overview
RefChem:315156 (CAS 86746-07-8), with molecular formula C22H27Cl4N3O2 and molecular weight 505.09 g/mol. IUPAC: N-[3-[4-(2-methylphenyl)piperazin-1-ium-1-yl]propyl]-2-(2,4,5-trichlorophenoxy)acetamide chloride.
Chemical Property Profile of RefChem:315156
Property Insights of RefChem:315156
The XLogP value of 0.25 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:315156. With a topological polar surface area (TPSA) of 46.0 Ų, RefChem:315156 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:315156 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:315156?
The CAS number of RefChem:315156 is 86746-07-8.
What is the molecular formula of RefChem:315156?
The molecular formula of RefChem:315156 is C22H27Cl4N3O2.
What is the molecular weight of RefChem:315156?
The molecular weight of RefChem:315156 is 505.09 g/mol.
Where can I buy RefChem:315156?
You can request a quote for RefChem:315156 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:315156?
Yes, KEHONG BIO provides custom synthesis services for RefChem:315156 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.