RefChem:1062007
TL;DR: RefChem:1062007 (CAS 20228-95-9) is a chemical compound with molecular formula C14H19Cl3N2O2 and molecular weight 352.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-piperidin-1-ium-1-ylethyl N-(2,6-dichlorophenyl)carbamate chloride
Also Known As: 2-Piperidinoethyl 2,6-dichlorocarbanilate hydrochloride, 2,6-Dichlorocarbanilic acid 2-piperidinoethyl ester hydrochloride, 2-piperidin-1-ium-1-ylethyl N-(2,6-dichlorophenyl)carbamate chloride, CARBANILIC ACID, 2,6-DICHLORO-, 2-PIPERIDINOETHYL ESTER, HYDROCHLORIDE, 2-(Piperidin-1-yl)ethyl hydrogen (2,6-dichlorophenyl)carbonimidate--hydrogen chloride (1/1)
| Molecular Formula | C14H19Cl3N2O2 |
|---|---|
| Molecular Weight | 352.05 g/mol |
| LogP | -0.39 |
| Topological Polar Surface Area | 42.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 352.0512 |
| Heavy Atoms | 21 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 20228-95-9 |
|---|---|
| SMILES | C1CC[NH+](CC1)CCOC(=O)NC2=C(C=CC=C2Cl)Cl.[Cl-] |
| InChIKey | VYNIUAYENUFLOL-UHFFFAOYSA-N |
Product Overview
RefChem:1062007 (CAS 20228-95-9), with molecular formula C14H19Cl3N2O2 and molecular weight 352.05 g/mol. IUPAC: 2-piperidin-1-ium-1-ylethyl N-(2,6-dichlorophenyl)carbamate chloride.
Chemical Property Profile of RefChem:1062007
Property Insights of RefChem:1062007
The XLogP value of -0.39 indicates that RefChem:1062007 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:1062007 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1062007 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:1062007?
The CAS number of RefChem:1062007 is 20228-95-9.
What is the molecular formula of RefChem:1062007?
The molecular formula of RefChem:1062007 is C14H19Cl3N2O2.
What is the molecular weight of RefChem:1062007?
The molecular weight of RefChem:1062007 is 352.05 g/mol.
Where can I buy RefChem:1062007?
You can request a quote for RefChem:1062007 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1062007?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1062007 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.