![N-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methylpropanamide structure](/static/products/876/876902-89-5.png)
N-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methylpropanamide
TL;DR: N-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methylpropanamide (CAS 876902-89-5) is a chemical compound with molecular formula C13H14ClN3O2 and molecular weight 279.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methylpropanamide
Also Known As: BAS 12529655, N-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methylpropanamide, N-((3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl)methyl)isobutyramide, N-[3-(2-Chloro-phenyl)-[1,2,4]oxadiazol-5-ylmethyl]-isobutyramide, N-{[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-methylpropanamide
| Molecular Formula | C13H14ClN3O2 |
|---|---|
| Molecular Weight | 279.08 g/mol |
| LogP | 2.6622 |
| Topological Polar Surface Area | 68.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 279.07745 |
| Heavy Atoms | 19 |
| Complexity | 580.7722 |
Chemical Identifiers
| CAS Number | 876902-89-5 |
|---|---|
| SMILES | CC(C)C(=O)NCC1=NC(=NO1)C2=CC=CC=C2Cl |
Product Overview
N-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methylpropanamide (CAS 876902-89-5), with molecular formula C13H14ClN3O2 and molecular weight 279.08 g/mol. IUPAC: N-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methylpropanamide.
Chemical Property Profile of N-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methylpropanamide
Property Insights of N-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methylpropanamide
The XLogP value of 2.6622 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methylpropanamide. The TPSA of 68.02 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methylpropanamide. Following Lipinski's Rule of Five, N-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methylpropanamide 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-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methylpropanamide?
The CAS number of N-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methylpropanamide is 876902-89-5.
What is the molecular formula of N-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methylpropanamide?
The molecular formula of N-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methylpropanamide is C13H14ClN3O2.
What is the molecular weight of N-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methylpropanamide?
The molecular weight of N-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methylpropanamide is 279.08 g/mol.
Where can I buy N-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methylpropanamide?
You can request a quote for N-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methylpropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.