RefChem:321582
TL;DR: RefChem:321582 (CAS 63639-55-4) is a chemical compound with molecular formula C22H28ClN3O3 and molecular weight 417.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-acetamido-N-(1-benzylpiperidin-1-ium-4-yl)-2-methoxybenzamide chloride
Also Known As: 4-(Acetylamino)-2-methoxy-N-(1-(phenylmethyl)-4-piperidinyl)benzamide hydrochloride, Benzamide, 4-(acetylamino)-2-methoxy-N-(1-(phenylmethyl)-4-piperidinyl)-, monohydrochloride, 4-acetamido-N-(1-benzylpiperidin-1-ium-4-yl)-2-methoxybenzamide chloride, BENZAMIDE, 4-(ACETYLAMINO)-2-METHOXY-N-(1-(PHENYLMETHYL)-4-PIPERIDINYL)-, MONOHY, RefChem:321582
| Molecular Formula | C22H28ClN3O3 |
|---|---|
| Molecular Weight | 417.18 g/mol |
| LogP | -1.37 |
| Topological Polar Surface Area | 71.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 417.18192 |
| Heavy Atoms | 29 |
| Complexity | 513.0 |
Chemical Identifiers
| CAS Number | 63639-55-4 |
|---|---|
| SMILES | CC(=O)NC1=CC(=C(C=C1)C(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3)OC.[Cl-] |
| InChIKey | VJALSXPGRAWJMJ-UHFFFAOYSA-N |
Product Overview
RefChem:321582 (CAS 63639-55-4), with molecular formula C22H28ClN3O3 and molecular weight 417.18 g/mol. IUPAC: 4-acetamido-N-(1-benzylpiperidin-1-ium-4-yl)-2-methoxybenzamide chloride.
Chemical Property Profile of RefChem:321582
Property Insights of RefChem:321582
The XLogP value of -1.37 indicates that RefChem:321582 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 71.9 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:321582. Following Lipinski's Rule of Five, RefChem:321582 has 3 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:321582?
The CAS number of RefChem:321582 is 63639-55-4.
What is the molecular formula of RefChem:321582?
The molecular formula of RefChem:321582 is C22H28ClN3O3.
What is the molecular weight of RefChem:321582?
The molecular weight of RefChem:321582 is 417.18 g/mol.
Where can I buy RefChem:321582?
You can request a quote for RefChem:321582 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:321582?
Yes, KEHONG BIO provides custom synthesis services for RefChem:321582 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.