RefChem:1090986
TL;DR: RefChem:1090986 (CAS 77966-63-3) is a chemical compound with molecular formula C15H22Cl2N2O and molecular weight 316.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chloro-6-methylphenyl)-2-(2-methylpiperidin-1-ium-1-yl)acetamide chloride
Also Known As: 6'-Chloro-2-(2-methylpiperidino)-o-acetotoluidide, hydrochloride, o-ACETOTOLUIDIDE, 6'-CHLORO-2-(2-METHYLPIPERIDINO)-, HYDROCHLORIDE, N-(2-CHLORO-6-METHYLPHENYL)-2-(2-METHYLPIPERIDIN-1-IUM-1-YL)ACETAMIDECHLORIDE, N-(2-chloro-6-methylphenyl)-2-(2-methylpiperidin-1-yl)acetamide,chloride, N-(2-chloro-6-methylphenyl)-2-(2-methylpiperidin-1-ium-1-yl)acetamide chloride
| Molecular Formula | C15H22Cl2N2O |
|---|---|
| Molecular Weight | 316.11 g/mol |
| LogP | -0.95 |
| Topological Polar Surface Area | 33.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 316.11093 |
| Heavy Atoms | 20 |
| Complexity | 311.0 |
Chemical Identifiers
| CAS Number | 77966-63-3 |
|---|---|
| SMILES | CC1CCCC[NH+]1CC(=O)NC2=C(C=CC=C2Cl)C.[Cl-] |
| InChIKey | MZJVBBMILYWYPO-UHFFFAOYSA-N |
Product Overview
RefChem:1090986 (CAS 77966-63-3), with molecular formula C15H22Cl2N2O and molecular weight 316.11 g/mol. IUPAC: N-(2-chloro-6-methylphenyl)-2-(2-methylpiperidin-1-ium-1-yl)acetamide chloride.
Chemical Property Profile of RefChem:1090986
Property Insights of RefChem:1090986
The XLogP value of -0.95 indicates that RefChem:1090986 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 33.5 Ų, RefChem:1090986 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1090986 has 2 hydrogen bond donor(s) and 2 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:1090986?
The CAS number of RefChem:1090986 is 77966-63-3.
What is the molecular formula of RefChem:1090986?
The molecular formula of RefChem:1090986 is C15H22Cl2N2O.
What is the molecular weight of RefChem:1090986?
The molecular weight of RefChem:1090986 is 316.11 g/mol.
Where can I buy RefChem:1090986?
You can request a quote for RefChem:1090986 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1090986?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1090986 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.