RefChem:1091874
TL;DR: RefChem:1091874 (CAS 77791-42-5) is a chemical compound with molecular formula C17H27ClN2O2 and molecular weight 326.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-2-(2-methylpiperidin-1-ium-1-yl)-N-(2-phenoxyethyl)acetamide chloride
Also Known As: C 6575, N-Methyl-2-(2-methylpiperidino)-N-(2-phenoxyethyl)acetamide hydrochloride, ACETAMIDE, N-METHYL-2-(2-METHYLPIPERIDINO)-N-(2-PHENOXYETHYL)-, HYDROCHLORIDE, N-METHYL-2-(2-METHYLPIPERIDIN-1-IUM-1-YL)-N-(2-PHENOXYETHYL)ACETAMIDECHLORIDE, N-methyl-2-(2-methylpiperidin-1-yl)-N-(2-phenoxyethyl)acetamide,chloride
| Molecular Formula | C17H27ClN2O2 |
|---|---|
| Molecular Weight | 326.18 g/mol |
| LogP | -2.01 |
| Topological Polar Surface Area | 34.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 326.17612 |
| Heavy Atoms | 22 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 77791-42-5 |
|---|---|
| SMILES | CC1CCCC[NH+]1CC(=O)N(C)CCOC2=CC=CC=C2.[Cl-] |
| InChIKey | PJHYRJHEDLSAHV-UHFFFAOYSA-N |
Product Overview
RefChem:1091874 (CAS 77791-42-5), with molecular formula C17H27ClN2O2 and molecular weight 326.18 g/mol. IUPAC: N-methyl-2-(2-methylpiperidin-1-ium-1-yl)-N-(2-phenoxyethyl)acetamide chloride.
Chemical Property Profile of RefChem:1091874
Property Insights of RefChem:1091874
The XLogP value of -2.01 indicates that RefChem:1091874 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 34.0 Ų, RefChem:1091874 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1091874 has 1 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:1091874?
The CAS number of RefChem:1091874 is 77791-42-5.
What is the molecular formula of RefChem:1091874?
The molecular formula of RefChem:1091874 is C17H27ClN2O2.
What is the molecular weight of RefChem:1091874?
The molecular weight of RefChem:1091874 is 326.18 g/mol.
Where can I buy RefChem:1091874?
You can request a quote for RefChem:1091874 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1091874?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1091874 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.