RefChem:314920
TL;DR: RefChem:314920 (CAS 101651-36-9) is a chemical compound with molecular formula C21H35ClN2O2 and molecular weight 382.24 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-[1-(2,4,6-trimethylphenoxy)propan-2-yl]acetamide chloride
Also Known As: C 2048, N-(1-Mesityloxy-2-propyl)-N-methyl-2-(2-methylpiperidino)acetamide hydrochloride, Acetamide, N-(1-mesityloxy-2-propyl)-N-methyl-2-(2-methylpiperidino)-, hydrochloride, N-methyl-2-(2-methylpiperidin-1-ium-1-yl)-N-[1-(2,4,6-trimethylphenoxy)propan-2-yl]acetamide chloride, 2-methyl-1-(2-{methyl[1-(2,4,6-trimethylphenoxy)propan-2-yl]amino}-2-oxoethyl)piperidinium chloride
| Molecular Formula | C21H35ClN2O2 |
|---|---|
| Molecular Weight | 382.24 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 34.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 382.2387 |
| Heavy Atoms | 26 |
| Complexity | 416.0 |
Chemical Identifiers
| CAS Number | 101651-36-9 |
|---|---|
| SMILES | CC1CCCC[NH+]1CC(=O)N(C)C(C)COC2=C(C=C(C=C2C)C)C.[Cl-] |
| InChIKey | BQSCLMKEJIQCFR-UHFFFAOYSA-N |
Product Overview
RefChem:314920 (CAS 101651-36-9), with molecular formula C21H35ClN2O2 and molecular weight 382.24 g/mol. IUPAC: N-methyl-2-(2-methylpiperidin-1-ium-1-yl)-N-[1-(2,4,6-trimethylphenoxy)propan-2-yl]acetamide chloride.
Chemical Property Profile of RefChem:314920
Property Insights of RefChem:314920
The XLogP value of -0.7 indicates that RefChem:314920 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:314920 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:314920 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:314920?
The CAS number of RefChem:314920 is 101651-36-9.
What is the molecular formula of RefChem:314920?
The molecular formula of RefChem:314920 is C21H35ClN2O2.
What is the molecular weight of RefChem:314920?
The molecular weight of RefChem:314920 is 382.24 g/mol.
Where can I buy RefChem:314920?
You can request a quote for RefChem:314920 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:314920?
Yes, KEHONG BIO provides custom synthesis services for RefChem:314920 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.