RefChem:232225
TL;DR: RefChem:232225 (CAS 2809-60-1) is a chemical compound with molecular formula C20H26N2 and molecular weight 294.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[ethyl(methyl)amino]ethyl]-3-methyl-2-naphthalen-1-ylbutanenitrile
Also Known As: alpha-(2-(N-Ethyl-N-methylamino)ethyl)-alpha-isopropyl-1-naphthaleneacetonitrile, 1-Naphthaleneacetonitrile, alpha-(2-(N-ethyl-N-methylamino)ethyl)-alpha-isopropyl-, 2-[2-[ethyl(methyl)amino]ethyl]-3-methyl-2-naphthalen-1-ylbu, 2-{2-[ETHYL(METHYL)AMINO]ETHYL}-3-METHYL-2-(NAPHTHALEN-1-YL)BUTANENITRILE, 1-Naphthaleneacetonitrile,a-[2-(ethylmethylamino)ethyl]-a-(1-methylethyl)-
| Molecular Formula | C20H26N2 |
|---|---|
| Molecular Weight | 294.21 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 27.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 294.2096 |
| Heavy Atoms | 22 |
| Complexity | 394.0 |
Chemical Identifiers
| CAS Number | 2809-60-1 |
|---|---|
| SMILES | CCN(C)CCC(C#N)(C1=CC=CC2=CC=CC=C21)C(C)C |
| InChIKey | ZIRVTXQLOJWYHT-UHFFFAOYSA-N |
Product Overview
RefChem:232225 (CAS 2809-60-1), with molecular formula C20H26N2 and molecular weight 294.21 g/mol. IUPAC: 2-[2-[ethyl(methyl)amino]ethyl]-3-methyl-2-naphthalen-1-ylbutanenitrile.
Chemical Property Profile of RefChem:232225
Property Insights of RefChem:232225
The XLogP value of 4.8 indicates that RefChem:232225 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.0 Ų, RefChem:232225 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:232225 has 0 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 RefChem:232225?
The CAS number of RefChem:232225 is 2809-60-1.
What is the molecular formula of RefChem:232225?
The molecular formula of RefChem:232225 is C20H26N2.
What is the molecular weight of RefChem:232225?
The molecular weight of RefChem:232225 is 294.21 g/mol.
Where can I buy RefChem:232225?
You can request a quote for RefChem:232225 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:232225?
Yes, KEHONG BIO provides custom synthesis services for RefChem:232225 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.