RefChem:325821
TL;DR: RefChem:325821 (CAS 20904-17-0) is a chemical compound with molecular formula C19H25Cl2N3O and molecular weight 381.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl-[3-[2-(phenoxymethyl)-3H-benzimidazol-1-ium-1-yl]propyl]azanium dichloride
Also Known As: 1-(3-Dimethylaminopropyl)-2-(phenoxymethyl)benzimidazole dihydrochloride hydrate, Benzimidazole, 1-(3-(dimethylamino)propyl)-2-(phenoxymethyl)-, hydrochloride, hydrate (1:2:1), 3-[3-(dimethylammonio)propyl]-2-(phenoxymethyl)-1H-benzimidazol-3-ium dichloride, dimethyl-[3-[2-(phenoxymethyl)-3H-benzimidazol-1-ium-1-yl]propyl]azanium dichloride, RefChem:325821
| Molecular Formula | C19H25Cl2N3O |
|---|---|
| Molecular Weight | 381.14 g/mol |
| LogP | -4.42 |
| Topological Polar Surface Area | 33.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 381.13748 |
| Heavy Atoms | 25 |
| Complexity | 344.0 |
Chemical Identifiers
| CAS Number | 20904-17-0 |
|---|---|
| SMILES | C[NH+](C)CCC[N+]1=C(NC2=CC=CC=C21)COC3=CC=CC=C3.[Cl-].[Cl-] |
| InChIKey | TUKQWDIPDAZSKD-UHFFFAOYSA-N |
Product Overview
RefChem:325821 (CAS 20904-17-0), with molecular formula C19H25Cl2N3O and molecular weight 381.14 g/mol. IUPAC: dimethyl-[3-[2-(phenoxymethyl)-3H-benzimidazol-1-ium-1-yl]propyl]azanium dichloride.
Chemical Property Profile of RefChem:325821
Property Insights of RefChem:325821
The XLogP value of -4.42 indicates that RefChem:325821 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:325821 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:325821 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:325821?
The CAS number of RefChem:325821 is 20904-17-0.
What is the molecular formula of RefChem:325821?
The molecular formula of RefChem:325821 is C19H25Cl2N3O.
What is the molecular weight of RefChem:325821?
The molecular weight of RefChem:325821 is 381.14 g/mol.
Where can I buy RefChem:325821?
You can request a quote for RefChem:325821 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:325821?
Yes, KEHONG BIO provides custom synthesis services for RefChem:325821 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.