RefChem:325968
TL;DR: RefChem:325968 (CAS 102516-90-5) is a chemical compound with molecular formula C21H27Cl2N3O and molecular weight 407.1531 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[6-chloro-2-[(4-methoxyphenyl)methyl]benzimidazol-1-yl]ethyl-diethylazanium chloride
Also Known As: Benzimidazole, 6-chloro-1-(2-(diethylamino)ethyl)-2-(p-methoxybenzyl)-, hydrochloride, 6-Chloro-1-(2-diethylaminoethyl)-2-(p-methoxybenzyl)benzimidazole hydrochloride, 2-(6-Chloro-2-(4-methoxybenzyl)-1H-benzimidazol-1-yl)-N,N-diethylethanamine hydrochloride, 2-[6-chloro-2-[(4-methoxyphenyl)methyl]benzimidazol-1-yl]ethyl-diethylazanium chloride
Technical Specifications
| Molecular Formula | C21H27Cl2N3O |
| Molecular Weight | 407.1531 g/mol |
| XLogP | 0.22 |
| Topological Polar Surface Area (TPSA) | 31.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 407.1531 Da |
| Heavy Atoms | 27 |
| Complexity | 412.0 |
| SMILES | CC[NH+](CC)CCN1C2=C(C=CC(=C2)Cl)N=C1CC3=CC=C(C=C3)OC.[Cl-] |
| InChIKey | RZAVFGNMQHMDLC-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:325968
Property Insights of RefChem:325968
The XLogP value of 0.22 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:325968. With a topological polar surface area (TPSA) of 31.5 Ų, RefChem:325968 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:325968 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:325968?
The CAS number of RefChem:325968 is 102516-90-5.
What is the molecular formula of RefChem:325968?
The molecular formula of RefChem:325968 is C21H27Cl2N3O.
What is the molecular weight of RefChem:325968?
The molecular weight of RefChem:325968 is 407.1531 g/mol.
Where can I buy RefChem:325968?
You can request a quote for RefChem:325968 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:325968?
Yes, CoreyChem provides custom synthesis services for RefChem:325968 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.