RefChem:1078010
TL;DR: RefChem:1078010 (CAS 57645-35-9) is a chemical compound with molecular formula C20H24Cl2N2O2 and molecular weight 394.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-benzylpiperidin-1-ium-4-yl)-5-chloro-2-methoxybenzamide chloride
Also Known As: 5-Chloro-2-methoxy-N-(1-(phenylmethyl)-4-piperidinyl)benzamide hydrochloride, Benzamide, 5-chloro-2-methoxy-N-(1-(phenylmethyl)-4-piperidinyl)-, monohydrochloride, 5-Chloro-2-methoxy-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]benzamidechloride, N-(1-benzylpiperidin-1-ium-4-yl)-5-chloro-2-methoxybenzamide chloride, BENZAMIDE, 5-CHLORO-2-METHOXY-N-(1-(PHENYLMETHYL)-4-PIPERIDINYL)-, MONOHYDROCHLO
| Molecular Formula | C20H24Cl2N2O2 |
|---|---|
| Molecular Weight | 394.12 g/mol |
| LogP | -0.67 |
| Topological Polar Surface Area | 42.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 394.1215 |
| Heavy Atoms | 26 |
| Complexity | 420.0 |
Chemical Identifiers
| CAS Number | 57645-35-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Cl)C(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3.[Cl-] |
| InChIKey | VLODGGMDYMSTHY-UHFFFAOYSA-N |
Product Overview
RefChem:1078010 (CAS 57645-35-9), with molecular formula C20H24Cl2N2O2 and molecular weight 394.12 g/mol. IUPAC: N-(1-benzylpiperidin-1-ium-4-yl)-5-chloro-2-methoxybenzamide chloride.
Chemical Property Profile of RefChem:1078010
Property Insights of RefChem:1078010
The XLogP value of -0.67 indicates that RefChem:1078010 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 42.8 Ų, RefChem:1078010 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1078010 has 2 hydrogen bond donor(s) and 3 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:1078010?
The CAS number of RefChem:1078010 is 57645-35-9.
What is the molecular formula of RefChem:1078010?
The molecular formula of RefChem:1078010 is C20H24Cl2N2O2.
What is the molecular weight of RefChem:1078010?
The molecular weight of RefChem:1078010 is 394.12 g/mol.
Where can I buy RefChem:1078010?
You can request a quote for RefChem:1078010 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1078010?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1078010 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.