RefChem:332356
TL;DR: RefChem:332356 (CAS 67049-82-5) is a chemical compound with molecular formula C13H23Cl2N3O2 and molecular weight 323.11673 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-(dimethylcarbamoyloxy)pyridin-1-ium-2-yl]methyl-diethylazanium dichloride
Also Known As: Ro 2-2219, Carbamic acid, dimethyl-, (2-((diethylamino)methyl)-3-pyridyl) ester, dihydrochloride, Dimethylcarbamic acid (2-((diethylamino)methyl)-3-pyridyl) ester dihydrochloride, [3-(Dimethylcarbamoyloxy)pyridin-1-ium-2-yl]methyl-diethylazaniumdichloride, [3-(dimethylcarbamoyloxy)pyridin-1-ium-2-yl]methyl-diethylazanium dichloride
Technical Specifications
| Molecular Formula | C13H23Cl2N3O2 |
| Molecular Weight | 323.11673 g/mol |
| XLogP | -6.01 |
| Topological Polar Surface Area (TPSA) | 48.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 323.11673 Da |
| Heavy Atoms | 20 |
| Complexity | 255.0 |
| SMILES | CC[NH+](CC)CC1=C(C=CC=[NH+]1)OC(=O)N(C)C.[Cl-].[Cl-] |
| InChIKey | QYKBOZPSEYLXRL-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:332356
Property Insights of RefChem:332356
The XLogP value of -6.01 indicates that RefChem:332356 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 48.1 Ų, RefChem:332356 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:332356 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:332356?
The CAS number of RefChem:332356 is 67049-82-5.
What is the molecular formula of RefChem:332356?
The molecular formula of RefChem:332356 is C13H23Cl2N3O2.
What is the molecular weight of RefChem:332356?
The molecular weight of RefChem:332356 is 323.11673 g/mol.
Where can I buy RefChem:332356?
You can request a quote for RefChem:332356 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:332356?
Yes, CoreyChem provides custom synthesis services for RefChem:332356 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.