![N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine structure](/static/products/876/876893-54-8.png)
N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine
TL;DR: N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine (CAS 876893-54-8) is a chemical compound with molecular formula C11H12ClN3O and molecular weight 237.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine
Also Known As: BAS 11358469, N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine, [3-(4-Chloro-phenyl)-[1,2,4]oxadiazol-5-ylmethyl]-ethyl-amine, N-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}ethanamine
| Molecular Formula | C11H12ClN3O |
|---|---|
| Molecular Weight | 237.07 g/mol |
| LogP | 2.4995 |
| Topological Polar Surface Area | 50.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 237.0669 |
| Heavy Atoms | 16 |
| Complexity | 452.50818 |
Chemical Identifiers
| CAS Number | 876893-54-8 |
|---|---|
| SMILES | CCNCC1=NC(=NO1)C2=CC=C(C=C2)Cl |
Product Overview
N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine (CAS 876893-54-8), with molecular formula C11H12ClN3O and molecular weight 237.07 g/mol. IUPAC: N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine.
Chemical Property Profile of N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine
Property Insights of N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine
The XLogP value of 2.4995 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine. With a topological polar surface area (TPSA) of 50.95 Ų, N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine has 1 hydrogen bond donor(s) and 4 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 N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine?
The CAS number of N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine is 876893-54-8.
What is the molecular formula of N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine?
The molecular formula of N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine is C11H12ClN3O.
What is the molecular weight of N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine?
The molecular weight of N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine is 237.07 g/mol.
Where can I buy N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine?
You can request a quote for N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine?
Yes, KEHONG BIO provides custom synthesis services for N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.