4-chloro-N-(2-((4-methyl-1,2,5-oxadiazol-3-yl)oxy)propyl)-2-nitroaniline
TL;DR: 4-chloro-N-(2-((4-methyl-1,2,5-oxadiazol-3-yl)oxy)propyl)-2-nitroaniline (CAS 593238-24-5) is a chemical compound with molecular formula C12H13ClN4O4 and molecular weight 312.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]propyl]-2-nitroaniline
Also Known As: 4-chloro-N-(2-((4-methyl-1,2,5-oxadiazol-3-yl)oxy)propyl)-2-nitroaniline, 4-chloro-N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]propyl}-2-nitroaniline, 4-chloro-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]propyl]-2-nitroaniline
| Molecular Formula | C12H13ClN4O4 |
|---|---|
| Molecular Weight | 312.06 g/mol |
| LogP | 2.81902 |
| Topological Polar Surface Area | 103.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 312.06253 |
| Heavy Atoms | 21 |
| Complexity | 645.9377 |
Chemical Identifiers
| CAS Number | 593238-24-5 |
|---|---|
| SMILES | CC1=NON=C1OC(C)CNC2=C(C=C(C=C2)Cl)[N+](=O)[O-] |
Product Overview
4-chloro-N-(2-((4-methyl-1,2,5-oxadiazol-3-yl)oxy)propyl)-2-nitroaniline (CAS 593238-24-5), with molecular formula C12H13ClN4O4 and molecular weight 312.06 g/mol. IUPAC: 4-chloro-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]propyl]-2-nitroaniline.
Chemical Property Profile of 4-chloro-N-(2-((4-methyl-1,2,5-oxadiazol-3-yl)oxy)propyl)-2-nitroaniline
Property Insights of 4-chloro-N-(2-((4-methyl-1,2,5-oxadiazol-3-yl)oxy)propyl)-2-nitroaniline
The XLogP value of 2.81902 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-N-(2-((4-methyl-1,2,5-oxadiazol-3-yl)oxy)propyl)-2-nitroaniline. The TPSA of 103.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-N-(2-((4-methyl-1,2,5-oxadiazol-3-yl)oxy)propyl)-2-nitroaniline. Following Lipinski's Rule of Five, 4-chloro-N-(2-((4-methyl-1,2,5-oxadiazol-3-yl)oxy)propyl)-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 4-chloro-N-(2-((4-methyl-1,2,5-oxadiazol-3-yl)oxy)propyl)-2-nitroaniline?
The CAS number of 4-chloro-N-(2-((4-methyl-1,2,5-oxadiazol-3-yl)oxy)propyl)-2-nitroaniline is 593238-24-5.
What is the molecular formula of 4-chloro-N-(2-((4-methyl-1,2,5-oxadiazol-3-yl)oxy)propyl)-2-nitroaniline?
The molecular formula of 4-chloro-N-(2-((4-methyl-1,2,5-oxadiazol-3-yl)oxy)propyl)-2-nitroaniline is C12H13ClN4O4.
What is the molecular weight of 4-chloro-N-(2-((4-methyl-1,2,5-oxadiazol-3-yl)oxy)propyl)-2-nitroaniline?
The molecular weight of 4-chloro-N-(2-((4-methyl-1,2,5-oxadiazol-3-yl)oxy)propyl)-2-nitroaniline is 312.06 g/mol.
Where can I buy 4-chloro-N-(2-((4-methyl-1,2,5-oxadiazol-3-yl)oxy)propyl)-2-nitroaniline?
You can request a quote for 4-chloro-N-(2-((4-methyl-1,2,5-oxadiazol-3-yl)oxy)propyl)-2-nitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-N-(2-((4-methyl-1,2,5-oxadiazol-3-yl)oxy)propyl)-2-nitroaniline?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-(2-((4-methyl-1,2,5-oxadiazol-3-yl)oxy)propyl)-2-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.