RefChem:1062014
TL;DR: RefChem:1062014 (CAS 20224-22-0) is a chemical compound with molecular formula C15H22Cl2N2O2 and molecular weight 332.11 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-(3-chloro-4-methylphenyl)carbamate chloride
Also Known As: 3-Chloro-4-methylcarbanilic acid 2-piperidinoethyl ester hydrochloride, CARBANILIC ACID, 3-CHLORO-4-METHYL-, 2-PIPERIDINOETHYL ESTER, HYDROCHLORIDE, 2-Piperidin-1-ium-1-ylethyl N-(3-chloro-4-methylphenyl)carbamatechloride, 2-piperidin-1-ium-1-ylethyl N-(3-chloro-4-methylphenyl)carbamate chloride, 2-(Piperidin-1-yl)ethyl hydrogen (3-chloro-4-methylphenyl)carbonimidate--hydrogen chloride (1/1)
| Molecular Formula | C15H22Cl2N2O2 |
|---|---|
| Molecular Weight | 332.11 g/mol |
| LogP | -0.73 |
| Topological Polar Surface Area | 42.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 332.10583 |
| Heavy Atoms | 21 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 20224-22-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)OCC[NH+]2CCCCC2)Cl.[Cl-] |
| InChIKey | LMQOWJRVRFPYHA-UHFFFAOYSA-N |
Product Overview
RefChem:1062014 (CAS 20224-22-0), with molecular formula C15H22Cl2N2O2 and molecular weight 332.11 g/mol. IUPAC: 2-piperidin-1-ium-1-ylethyl N-(3-chloro-4-methylphenyl)carbamate chloride.
Chemical Property Profile of RefChem:1062014
Property Insights of RefChem:1062014
The XLogP value of -0.73 indicates that RefChem:1062014 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:1062014 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1062014 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:1062014?
The CAS number of RefChem:1062014 is 20224-22-0.
What is the molecular formula of RefChem:1062014?
The molecular formula of RefChem:1062014 is C15H22Cl2N2O2.
What is the molecular weight of RefChem:1062014?
The molecular weight of RefChem:1062014 is 332.11 g/mol.
Where can I buy RefChem:1062014?
You can request a quote for RefChem:1062014 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1062014?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1062014 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.