RefChem:319246
TL;DR: RefChem:319246 (CAS 66902-95-2) is a chemical compound with molecular formula C14H24BrN3O2 and molecular weight 345.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(dimethylcarbamoyloxy)-2-pyridinyl]methyl-diethyl-methylazanium bromide
Also Known As: Ro 2-2016, Diethyl(3-hydroxy-2-pyridylmethyl)methylammonium bromide dimethylcarbamate (ester), Ammonium, diethyl(3-hydroxy-2-pyridylmethyl)methyl-, bromide, dimethylcarbamate (ester), [3-(Dimethylcarbamoyloxy)pyridin-2-yl]methyl-diethyl-methylazaniumbromide, [3-(dimethylcarbamoyloxy)pyridin-2-yl]methyl-diethyl-methylazanium bromide
| Molecular Formula | C14H24BrN3O2 |
|---|---|
| Molecular Weight | 345.11 g/mol |
| LogP | -0.87 |
| Topological Polar Surface Area | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 345.1052 |
| Heavy Atoms | 20 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 66902-95-2 |
|---|---|
| SMILES | CC[N+](C)(CC)CC1=C(C=CC=N1)OC(=O)N(C)C.[Br-] |
| InChIKey | FGQMFAPOLGZXCO-UHFFFAOYSA-M |
Product Overview
RefChem:319246 (CAS 66902-95-2), with molecular formula C14H24BrN3O2 and molecular weight 345.11 g/mol. IUPAC: [3-(dimethylcarbamoyloxy)-2-pyridinyl]methyl-diethyl-methylazanium bromide.
Chemical Property Profile of RefChem:319246
Property Insights of RefChem:319246
The XLogP value of -0.87 indicates that RefChem:319246 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 42.4 Ų, RefChem:319246 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:319246 has 0 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:319246?
The CAS number of RefChem:319246 is 66902-95-2.
What is the molecular formula of RefChem:319246?
The molecular formula of RefChem:319246 is C14H24BrN3O2.
What is the molecular weight of RefChem:319246?
The molecular weight of RefChem:319246 is 345.11 g/mol.
Where can I buy RefChem:319246?
You can request a quote for RefChem:319246 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:319246?
Yes, KEHONG BIO provides custom synthesis services for RefChem:319246 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.