RefChem:322309
TL;DR: RefChem:322309 (CAS 7176-59-2) is a chemical compound with molecular formula C22H30ClN3O3 and molecular weight 419.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(diethylamino)propyl]-4-nitro-N-(1-phenylethyl)benzamide;hydrochloride
Also Known As: N-(3-(Diethylamino)propyl)-N-(alpha-methylbenzyl)-p-nitrobenzamide hydrochloride, Benzamide, N-(3-(diethylamino)propyl)-N-(alpha-methylbenzyl)-p-nitro-, hydrochloride, N-[3-(diethylamino)propyl]-4-nitro-N-(1-phenylethyl)benzamide hydrochloride, N-[3-(Diethylamino)propyl]-4-nitro-N-(1-phenylethyl)benzamide--hydrogen chloride (1/1), RefChem:322309
| Molecular Formula | C22H30ClN3O3 |
|---|---|
| Molecular Weight | 419.20 g/mol |
| LogP | 4.9519 |
| Topological Polar Surface Area | 69.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 419.19757 |
| Heavy Atoms | 29 |
| Complexity | 476.0 |
Chemical Identifiers
| CAS Number | 7176-59-2 |
|---|---|
| SMILES | CCN(CC)CCCN(C(C)C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-].Cl |
| InChIKey | FOOLCNYKBZPPDR-UHFFFAOYSA-N |
Product Overview
RefChem:322309 (CAS 7176-59-2), with molecular formula C22H30ClN3O3 and molecular weight 419.20 g/mol. IUPAC: N-[3-(diethylamino)propyl]-4-nitro-N-(1-phenylethyl)benzamide;hydrochloride.
Chemical Property Profile of RefChem:322309
Property Insights of RefChem:322309
The XLogP value of 4.9519 indicates that RefChem:322309 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:322309. Following Lipinski's Rule of Five, RefChem:322309 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 RefChem:322309?
The CAS number of RefChem:322309 is 7176-59-2.
What is the molecular formula of RefChem:322309?
The molecular formula of RefChem:322309 is C22H30ClN3O3.
What is the molecular weight of RefChem:322309?
The molecular weight of RefChem:322309 is 419.20 g/mol.
Where can I buy RefChem:322309?
You can request a quote for RefChem:322309 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:322309?
Yes, KEHONG BIO provides custom synthesis services for RefChem:322309 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.