RefChem:332358
TL;DR: RefChem:332358 (CAS 67049-90-5) is a chemical compound with molecular formula C10H17Cl2N3O2 and molecular weight 281.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(dimethylcarbamoyloxy)pyridin-1-ium-2-yl]methyl-methylazanium dichloride
Also Known As: Ro 2-2235, Carbamic acid, dimethyl-, (2-((methylamino)methyl)-3-pyridyl) ester, dihydrochloride, Dimethylcarbamic acid (2-((methylamino)methyl)-3-pyridyl) ester dihydrochloride, [3-(Dimethylcarbamoyloxy)pyridin-1-ium-2-yl]methyl-methylazaniumdichloride, [3-(dimethylcarbamoyloxy)pyridin-1-ium-2-yl]methyl-methylazanium dichloride
| Molecular Formula | C10H17Cl2N3O2 |
|---|---|
| Molecular Weight | 281.07 g/mol |
| LogP | -6.74 |
| Topological Polar Surface Area | 60.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 281.0698 |
| Heavy Atoms | 17 |
| Complexity | 209.0 |
Chemical Identifiers
| CAS Number | 67049-90-5 |
|---|---|
| SMILES | C[NH2+]CC1=C(C=CC=[NH+]1)OC(=O)N(C)C.[Cl-].[Cl-] |
| InChIKey | YBIGOUWXNQUEOJ-UHFFFAOYSA-N |
Product Overview
RefChem:332358 (CAS 67049-90-5), with molecular formula C10H17Cl2N3O2 and molecular weight 281.07 g/mol. IUPAC: [3-(dimethylcarbamoyloxy)pyridin-1-ium-2-yl]methyl-methylazanium dichloride.
Chemical Property Profile of RefChem:332358
Property Insights of RefChem:332358
The XLogP value of -6.74 indicates that RefChem:332358 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 60.3 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:332358. Following Lipinski's Rule of Five, RefChem:332358 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
Frequently Asked Questions
What is the CAS number of RefChem:332358?
The CAS number of RefChem:332358 is 67049-90-5.
What is the molecular formula of RefChem:332358?
The molecular formula of RefChem:332358 is C10H17Cl2N3O2.
What is the molecular weight of RefChem:332358?
The molecular weight of RefChem:332358 is 281.07 g/mol.
Where can I buy RefChem:332358?
You can request a quote for RefChem:332358 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:332358?
Yes, KEHONG BIO provides custom synthesis services for RefChem:332358 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.