5-chloro-N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-2-nitroaniline
TL;DR: 5-chloro-N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-2-nitroaniline (CAS 593238-23-4) is a chemical compound with molecular formula C11H11ClN4O4 and molecular weight 298.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitroaniline
Also Known As: A3533/0149694, 5-chloro-N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-2-nitroaniline, 5-chloro-N-(2-((4-methyl-1,2,5-oxadiazol-3-yl)oxy)ethyl)-2-nitroaniline, 5-chloro-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitroaniline, N-(5-chloro-2-nitrophenyl)-N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}amine
| Molecular Formula | C11H11ClN4O4 |
|---|---|
| Molecular Weight | 298.05 g/mol |
| LogP | 2.43052 |
| Topological Polar Surface Area | 103.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 298.04688 |
| Heavy Atoms | 20 |
| Complexity | 616.22064 |
Chemical Identifiers
| CAS Number | 593238-23-4 |
|---|---|
| SMILES | CC1=NON=C1OCCNC2=C(C=CC(=C2)Cl)[N+](=O)[O-] |
Product Overview
5-chloro-N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-2-nitroaniline (CAS 593238-23-4), with molecular formula C11H11ClN4O4 and molecular weight 298.05 g/mol. IUPAC: 5-chloro-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitroaniline.
Chemical Property Profile of 5-chloro-N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-2-nitroaniline
Property Insights of 5-chloro-N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-2-nitroaniline
The XLogP value of 2.43052 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-chloro-N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-2-nitroaniline. The TPSA of 103.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-chloro-N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-2-nitroaniline. Following Lipinski's Rule of Five, 5-chloro-N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-2-nitroaniline has 1 hydrogen bond donor(s) and 7 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 5-chloro-N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-2-nitroaniline?
The CAS number of 5-chloro-N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-2-nitroaniline is 593238-23-4.
What is the molecular formula of 5-chloro-N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-2-nitroaniline?
The molecular formula of 5-chloro-N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-2-nitroaniline is C11H11ClN4O4.
What is the molecular weight of 5-chloro-N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-2-nitroaniline?
The molecular weight of 5-chloro-N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-2-nitroaniline is 298.05 g/mol.
Where can I buy 5-chloro-N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-2-nitroaniline?
You can request a quote for 5-chloro-N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-2-nitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-chloro-N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-2-nitroaniline?
Yes, KEHONG BIO provides custom synthesis services for 5-chloro-N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-2-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.