RefChem:1097477
TL;DR: RefChem:1097477 (CAS 145234-99-7) is a chemical compound with molecular formula C17H23ClN4O4 and molecular weight 382.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(E)-[4-(dimethylamino)phenyl]methylideneamino]-N,N,6-trimethylpyridin-1-ium-3-amine perchlorate
Also Known As: Pyridinium, 5-(dimethylamino)-1-(((4-(dimethylamino)phenyl)methylene)amino)-2-methyl-, perchlorate, RefChem:1097477
| Molecular Formula | C17H23ClN4O4 |
|---|---|
| Molecular Weight | 382.14 g/mol |
| LogP | -2.45928 |
| Topological Polar Surface Area | 114.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 382.14078 |
| Heavy Atoms | 26 |
| Complexity | 722.533 |
Chemical Identifiers
| CAS Number | 145234-99-7 |
|---|---|
| SMILES | CC1=[N+](C=C(C=C1)N(C)C)/N=C/C2=CC=C(C=C2)N(C)C.[O-]Cl(=O)(=O)=O |
Product Overview
RefChem:1097477 (CAS 145234-99-7), with molecular formula C17H23ClN4O4 and molecular weight 382.14 g/mol. IUPAC: 1-[(E)-[4-(dimethylamino)phenyl]methylideneamino]-N,N,6-trimethylpyridin-1-ium-3-amine perchlorate.
Chemical Property Profile of RefChem:1097477
Property Insights of RefChem:1097477
The XLogP value of -2.45928 indicates that RefChem:1097477 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 114.96 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1097477. Following Lipinski's Rule of Five, RefChem:1097477 has 0 hydrogen bond donor(s) and 7 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:1097477?
The CAS number of RefChem:1097477 is 145234-99-7.
What is the molecular formula of RefChem:1097477?
The molecular formula of RefChem:1097477 is C17H23ClN4O4.
What is the molecular weight of RefChem:1097477?
The molecular weight of RefChem:1097477 is 382.14 g/mol.
Where can I buy RefChem:1097477?
You can request a quote for RefChem:1097477 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1097477?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1097477 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.