![4-chloro-N-[3-(dimethylamino)propyl]-2-nitrobenzamide structure](/static/products/5662/5662-98-6.webp)
4-chloro-N-[3-(dimethylamino)propyl]-2-nitrobenzamide
TL;DR: 4-chloro-N-[3-(dimethylamino)propyl]-2-nitrobenzamide (CAS 5662-98-6) is a chemical compound with molecular formula C12H16ClN3O3 and molecular weight 285.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[3-(dimethylamino)propyl]-2-nitrobenzamide
Also Known As: 4-chloro-N-[3-(dimethylamino)propyl]-2-nitrobenzamide, AB00092337-01, 4-chloro-N-(3-dimethylaminopropyl)-2-nitro-benzamide
| Molecular Formula | C12H16ClN3O3 |
|---|---|
| Molecular Weight | 285.09 g/mol |
| LogP | 1.9297 |
| Topological Polar Surface Area | 75.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 285.088 |
| Heavy Atoms | 19 |
| Complexity | 477.28745 |
Chemical Identifiers
| CAS Number | 5662-98-6 |
|---|---|
| SMILES | CN(C)CCCNC(=O)C1=C(C=C(C=C1)Cl)[N+](=O)[O-] |
Product Overview
4-chloro-N-[3-(dimethylamino)propyl]-2-nitrobenzamide (CAS 5662-98-6), with molecular formula C12H16ClN3O3 and molecular weight 285.09 g/mol. IUPAC: 4-chloro-N-[3-(dimethylamino)propyl]-2-nitrobenzamide.
Chemical Property Profile of 4-chloro-N-[3-(dimethylamino)propyl]-2-nitrobenzamide
Property Insights of 4-chloro-N-[3-(dimethylamino)propyl]-2-nitrobenzamide
The XLogP value of 1.9297 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-N-[3-(dimethylamino)propyl]-2-nitrobenzamide. The TPSA of 75.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-N-[3-(dimethylamino)propyl]-2-nitrobenzamide. Following Lipinski's Rule of Five, 4-chloro-N-[3-(dimethylamino)propyl]-2-nitrobenzamide 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 4-chloro-N-[3-(dimethylamino)propyl]-2-nitrobenzamide?
The CAS number of 4-chloro-N-[3-(dimethylamino)propyl]-2-nitrobenzamide is 5662-98-6.
What is the molecular formula of 4-chloro-N-[3-(dimethylamino)propyl]-2-nitrobenzamide?
The molecular formula of 4-chloro-N-[3-(dimethylamino)propyl]-2-nitrobenzamide is C12H16ClN3O3.
What is the molecular weight of 4-chloro-N-[3-(dimethylamino)propyl]-2-nitrobenzamide?
The molecular weight of 4-chloro-N-[3-(dimethylamino)propyl]-2-nitrobenzamide is 285.09 g/mol.
Where can I buy 4-chloro-N-[3-(dimethylamino)propyl]-2-nitrobenzamide?
You can request a quote for 4-chloro-N-[3-(dimethylamino)propyl]-2-nitrobenzamide 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-[3-(dimethylamino)propyl]-2-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-[3-(dimethylamino)propyl]-2-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.