RefChem:325812
TL;DR: RefChem:325812 (CAS 20904-15-8) is a chemical compound with molecular formula C18H23Cl2N3O and molecular weight 367.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl-[2-[2-(phenoxymethyl)-3H-benzimidazol-1-ium-1-yl]ethyl]azanium dichloride
Also Known As: 1-(2-Dimethylaminoethyl)-2-(phenoxymethyl)benzimidazole dihydrochloride dihydrate, Benzimidazole, 1-(2-(dimethylamino)ethyl)-2-(phenoxymethyl)-, hydrochloride, hydrate (1:2:2), DIMETHYL-[2-[2-(PHENOXYMETHYL)-3H-BENZIMIDAZOL-1-IUM-1-YL]ETHYL]AZANIUMDICHLORIDE, dimethyl-[2-[2-(phenoxymethyl)-3H-benzimidazol-1-ium-1-yl]ethyl]azanium dichloride, RefChem:325812
| Molecular Formula | C18H23Cl2N3O |
|---|---|
| Molecular Weight | 367.12 g/mol |
| LogP | -4.81 |
| Topological Polar Surface Area | 33.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 367.12183 |
| Heavy Atoms | 24 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 20904-15-8 |
|---|---|
| SMILES | C[NH+](C)CC[N+]1=C(NC2=CC=CC=C21)COC3=CC=CC=C3.[Cl-].[Cl-] |
| InChIKey | XEQYERYPHRVQAU-UHFFFAOYSA-N |
Product Overview
RefChem:325812 (CAS 20904-15-8), with molecular formula C18H23Cl2N3O and molecular weight 367.12 g/mol. IUPAC: dimethyl-[2-[2-(phenoxymethyl)-3H-benzimidazol-1-ium-1-yl]ethyl]azanium dichloride.
Chemical Property Profile of RefChem:325812
Property Insights of RefChem:325812
The XLogP value of -4.81 indicates that RefChem:325812 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 33.3 Ų, RefChem:325812 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:325812 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:325812?
The CAS number of RefChem:325812 is 20904-15-8.
What is the molecular formula of RefChem:325812?
The molecular formula of RefChem:325812 is C18H23Cl2N3O.
What is the molecular weight of RefChem:325812?
The molecular weight of RefChem:325812 is 367.12 g/mol.
Where can I buy RefChem:325812?
You can request a quote for RefChem:325812 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:325812?
Yes, KEHONG BIO provides custom synthesis services for RefChem:325812 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.