RefChem:232218
TL;DR: RefChem:232218 (CAS 50765-80-5) is a chemical compound with molecular formula C28H39ClN2 and molecular weight 438.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[bis(3-methylbut-2-enyl)amino]ethyl]-3-methyl-2-naphthalen-1-ylpentanenitrile;hydrochloride
Also Known As: 1-Naphthaleneacetonitrile, alpha-(2-(bis(3-methyl-2-butenyl)amino)ethyl)-alpha-(1-methylpropyl)-, monohydrochloride, 2-[2-(bis(3-methylbut-2-enyl)amino)ethyl]-3-methyl-2-naphthalen-1-yl-pentanenitrile Hydrochloride, 2-[2-[bis(3-methylbut-2-enyl)amino]ethyl]-3-methyl-2-naphthalen-1-ylpentanenitrile hydrochloride, 2-{2-[Bis(3-methylbut-2-en-1-yl)amino]ethyl}-3-methyl-2-(naphthalen-1-yl)pentanenitrile--hydrogen chloride (1/1), RefChem:232218
| Molecular Formula | C28H39ClN2 |
|---|---|
| Molecular Weight | 438.28 g/mol |
| LogP | 7.69358 |
| Topological Polar Surface Area | 27.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 438.28018 |
| Heavy Atoms | 31 |
| Complexity | 904.17316 |
Chemical Identifiers
| CAS Number | 50765-80-5 |
|---|---|
| SMILES | CCC(C)C(CCN(CC=C(C)C)CC=C(C)C)(C#N)C1=CC=CC2=CC=CC=C21.Cl |
Product Overview
RefChem:232218 (CAS 50765-80-5), with molecular formula C28H39ClN2 and molecular weight 438.28 g/mol. IUPAC: 2-[2-[bis(3-methylbut-2-enyl)amino]ethyl]-3-methyl-2-naphthalen-1-ylpentanenitrile;hydrochloride.
Chemical Property Profile of RefChem:232218
Property Insights of RefChem:232218
The XLogP value of 7.69358 indicates that RefChem:232218 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.03 Ų, RefChem:232218 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:232218 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:232218?
The CAS number of RefChem:232218 is 50765-80-5.
What is the molecular formula of RefChem:232218?
The molecular formula of RefChem:232218 is C28H39ClN2.
What is the molecular weight of RefChem:232218?
The molecular weight of RefChem:232218 is 438.28 g/mol.
Where can I buy RefChem:232218?
You can request a quote for RefChem:232218 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:232218?
Yes, KEHONG BIO provides custom synthesis services for RefChem:232218 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.