4',4''-Bis(imidazolin-2-yl-amino)terephthalanilide dihydrochloride
TL;DR: 4',4''-Bis(imidazolin-2-yl-amino)terephthalanilide dihydrochloride (CAS 114-77-2) is a chemical compound with molecular formula C26H28Cl2N8O2 and molecular weight 554.1712 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-N,4-N-bis[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]benzene-1,4-dicarboxamide;dihydrochloride
Also Known As: HR 2105, 3-phenyl-pyruvic acid,sodium salt, 4',4''-Bis(imidazolin-2-yl-amino)terephthalanilide dihydrochloride, Terephthalanilide, 4,4''-bis(2-imidazolin-2-ylamino)-, dihyd, n,n'-bis[4-(4,5-dihydro-1h-imidazol-2-ylamino)phenyl]benzene-1,4-dicarboxamide dihydrochloride
Technical Specifications
| Molecular Formula | C26H28Cl2N8O2 |
| Molecular Weight | 554.1712 g/mol |
| XLogP | 3.78 |
| Topological Polar Surface Area (TPSA) | 131.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 554.1712 Da |
| Heavy Atoms | 38 |
| Complexity | 754.0 |
| SMILES | C1CN=C(N1)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)NC5=NCCN5.Cl.Cl |
| InChIKey | LDKWVGSNUDHECR-UHFFFAOYSA-N |
Chemical Property Profile of 4',4''-Bis(imidazolin-2-yl-amino)terephthalanilide dihydrochloride
Property Insights of 4',4''-Bis(imidazolin-2-yl-amino)terephthalanilide dihydrochloride
The XLogP value of 3.78 indicates that 4',4''-Bis(imidazolin-2-yl-amino)terephthalanilide dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4',4''-Bis(imidazolin-2-yl-amino)terephthalanilide dihydrochloride. Following Lipinski's Rule of Five, 4',4''-Bis(imidazolin-2-yl-amino)terephthalanilide dihydrochloride has 8 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 4',4''-Bis(imidazolin-2-yl-amino)terephthalanilide dihydrochloride?
The CAS number of 4',4''-Bis(imidazolin-2-yl-amino)terephthalanilide dihydrochloride is 114-77-2.
What is the molecular formula of 4',4''-Bis(imidazolin-2-yl-amino)terephthalanilide dihydrochloride?
The molecular formula of 4',4''-Bis(imidazolin-2-yl-amino)terephthalanilide dihydrochloride is C26H28Cl2N8O2.
What is the molecular weight of 4',4''-Bis(imidazolin-2-yl-amino)terephthalanilide dihydrochloride?
The molecular weight of 4',4''-Bis(imidazolin-2-yl-amino)terephthalanilide dihydrochloride is 554.1712 g/mol.
Where can I buy 4',4''-Bis(imidazolin-2-yl-amino)terephthalanilide dihydrochloride?
You can request a quote for 4',4''-Bis(imidazolin-2-yl-amino)terephthalanilide dihydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4',4''-Bis(imidazolin-2-yl-amino)terephthalanilide dihydrochloride?
Yes, CoreyChem provides custom synthesis services for 4',4''-Bis(imidazolin-2-yl-amino)terephthalanilide dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.