2-chloro-N-(2-methyl-2-morpholin-4-ylpropyl)-4-nitroaniline
TL;DR: 2-chloro-N-(2-methyl-2-morpholin-4-ylpropyl)-4-nitroaniline (CAS 852225-25-3) is a chemical compound with molecular formula C14H20ClN3O3 and molecular weight 313.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(2-methyl-2-morpholin-4-ylpropyl)-4-nitroaniline
Also Known As: 2-chloro-N-(2-methyl-2-morpholin-4-ylpropyl)-4-nitroaniline, 2-chloro-N-(2-methyl-2-morpholin-4-yl-propyl)-4-nitro-aniline, 2-chloro-N-[2-methyl-2-(morpholin-4-yl)propyl]-4-nitroaniline
| Molecular Formula | C14H20ClN3O3 |
|---|---|
| Molecular Weight | 313.12 g/mol |
| LogP | 2.7709 |
| Topological Polar Surface Area | 67.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 313.11932 |
| Heavy Atoms | 21 |
| Complexity | 516.1857 |
Chemical Identifiers
| CAS Number | 852225-25-3 |
|---|---|
| SMILES | CC(C)(CNC1=C(C=C(C=C1)[N+](=O)[O-])Cl)N2CCOCC2 |
Product Overview
2-chloro-N-(2-methyl-2-morpholin-4-ylpropyl)-4-nitroaniline (CAS 852225-25-3), with molecular formula C14H20ClN3O3 and molecular weight 313.12 g/mol. IUPAC: 2-chloro-N-(2-methyl-2-morpholin-4-ylpropyl)-4-nitroaniline.
Chemical Property Profile of 2-chloro-N-(2-methyl-2-morpholin-4-ylpropyl)-4-nitroaniline
Property Insights of 2-chloro-N-(2-methyl-2-morpholin-4-ylpropyl)-4-nitroaniline
The XLogP value of 2.7709 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-N-(2-methyl-2-morpholin-4-ylpropyl)-4-nitroaniline. The TPSA of 67.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-N-(2-methyl-2-morpholin-4-ylpropyl)-4-nitroaniline. Following Lipinski's Rule of Five, 2-chloro-N-(2-methyl-2-morpholin-4-ylpropyl)-4-nitroaniline has 1 hydrogen bond donor(s) and 5 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 2-chloro-N-(2-methyl-2-morpholin-4-ylpropyl)-4-nitroaniline?
The CAS number of 2-chloro-N-(2-methyl-2-morpholin-4-ylpropyl)-4-nitroaniline is 852225-25-3.
What is the molecular formula of 2-chloro-N-(2-methyl-2-morpholin-4-ylpropyl)-4-nitroaniline?
The molecular formula of 2-chloro-N-(2-methyl-2-morpholin-4-ylpropyl)-4-nitroaniline is C14H20ClN3O3.
What is the molecular weight of 2-chloro-N-(2-methyl-2-morpholin-4-ylpropyl)-4-nitroaniline?
The molecular weight of 2-chloro-N-(2-methyl-2-morpholin-4-ylpropyl)-4-nitroaniline is 313.12 g/mol.
Where can I buy 2-chloro-N-(2-methyl-2-morpholin-4-ylpropyl)-4-nitroaniline?
You can request a quote for 2-chloro-N-(2-methyl-2-morpholin-4-ylpropyl)-4-nitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-(2-methyl-2-morpholin-4-ylpropyl)-4-nitroaniline?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-(2-methyl-2-morpholin-4-ylpropyl)-4-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.