RefChem:332706
TL;DR: RefChem:332706 (CAS 69766-56-9) is a chemical compound with molecular formula C18H24ClN3O2 and molecular weight 349.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-[[3-[methyl(phenyl)carbamoyl]oxy-2-pyridinyl]methyl]azanium chloride
Also Known As: Ro 2-2288, Carbamic acid, N-methyl-N-phenyl-, (2-(diethylamino)methyl-3-pyridyl)ester, hydrochloride, N-Methyl-N-phenylcarbamic acid (2-(diethylamino)methyl-3-pyridyl)ester hydrochloride, DIETHYL-[[3-[METHYL(PHENYL)CARBAMOYL]OXYPYRIDIN-2-YL]METHYL]AZANIUMCHLORIDE, diethyl-[[3-[methyl(phenyl)carbamoyl]oxypyridin-2-yl]methyl]azanium chloride
| Molecular Formula | C18H24ClN3O2 |
|---|---|
| Molecular Weight | 349.16 g/mol |
| LogP | -0.85 |
| Topological Polar Surface Area | 46.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 349.1557 |
| Heavy Atoms | 24 |
| Complexity | 354.0 |
Chemical Identifiers
| CAS Number | 69766-56-9 |
|---|---|
| SMILES | CC[NH+](CC)CC1=C(C=CC=N1)OC(=O)N(C)C2=CC=CC=C2.[Cl-] |
| InChIKey | SQCQMVBFUDYOKU-UHFFFAOYSA-N |
Product Overview
RefChem:332706 (CAS 69766-56-9), with molecular formula C18H24ClN3O2 and molecular weight 349.16 g/mol. IUPAC: diethyl-[[3-[methyl(phenyl)carbamoyl]oxy-2-pyridinyl]methyl]azanium chloride.
Chemical Property Profile of RefChem:332706
Property Insights of RefChem:332706
The XLogP value of -0.85 indicates that RefChem:332706 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.9 Ų, RefChem:332706 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:332706 has 1 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:332706?
The CAS number of RefChem:332706 is 69766-56-9.
What is the molecular formula of RefChem:332706?
The molecular formula of RefChem:332706 is C18H24ClN3O2.
What is the molecular weight of RefChem:332706?
The molecular weight of RefChem:332706 is 349.16 g/mol.
Where can I buy RefChem:332706?
You can request a quote for RefChem:332706 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:332706?
Yes, KEHONG BIO provides custom synthesis services for RefChem:332706 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.