2-chloro-N-[3-(diethylamino)propyl]-5-nitrobenzamide
TL;DR: 2-chloro-N-[3-(diethylamino)propyl]-5-nitrobenzamide (CAS 346724-33-2) 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-[3-(diethylamino)propyl]-5-nitrobenzamide
Also Known As: 2-chloro-N-[3-(diethylamino)propyl]-5-nitrobenzamide, BIM-0027059.P001, AB00091955-01, N-[3-(diethylamino)propyl](2-chloro-5-nitrophenyl)carboxamide
| Molecular Formula | C14H20ClN3O3 |
|---|---|
| Molecular Weight | 313.12 g/mol |
| LogP | 2.7099 |
| Topological Polar Surface Area | 75.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 313.11932 |
| Heavy Atoms | 21 |
| Complexity | 504.23764 |
Chemical Identifiers
| CAS Number | 346724-33-2 |
|---|---|
| SMILES | CCN(CC)CCCNC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])Cl |
Product Overview
2-chloro-N-[3-(diethylamino)propyl]-5-nitrobenzamide (CAS 346724-33-2), with molecular formula C14H20ClN3O3 and molecular weight 313.12 g/mol. IUPAC: 2-chloro-N-[3-(diethylamino)propyl]-5-nitrobenzamide.
Chemical Property Profile of 2-chloro-N-[3-(diethylamino)propyl]-5-nitrobenzamide
Property Insights of 2-chloro-N-[3-(diethylamino)propyl]-5-nitrobenzamide
The XLogP value of 2.7099 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-N-[3-(diethylamino)propyl]-5-nitrobenzamide. The TPSA of 75.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-N-[3-(diethylamino)propyl]-5-nitrobenzamide. Following Lipinski's Rule of Five, 2-chloro-N-[3-(diethylamino)propyl]-5-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 2-chloro-N-[3-(diethylamino)propyl]-5-nitrobenzamide?
The CAS number of 2-chloro-N-[3-(diethylamino)propyl]-5-nitrobenzamide is 346724-33-2.
What is the molecular formula of 2-chloro-N-[3-(diethylamino)propyl]-5-nitrobenzamide?
The molecular formula of 2-chloro-N-[3-(diethylamino)propyl]-5-nitrobenzamide is C14H20ClN3O3.
What is the molecular weight of 2-chloro-N-[3-(diethylamino)propyl]-5-nitrobenzamide?
The molecular weight of 2-chloro-N-[3-(diethylamino)propyl]-5-nitrobenzamide is 313.12 g/mol.
Where can I buy 2-chloro-N-[3-(diethylamino)propyl]-5-nitrobenzamide?
You can request a quote for 2-chloro-N-[3-(diethylamino)propyl]-5-nitrobenzamide 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-[3-(diethylamino)propyl]-5-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-[3-(diethylamino)propyl]-5-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.