RefChem:322638
TL;DR: RefChem:322638 (CAS 80785-16-6) is a chemical compound with molecular formula C27H33Cl4N3O and molecular weight 555.13776 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-[(3,4-dichloroanilino)-phenylmethylidene]azaniumylphenoxy]ethyl-di(propan-2-yl)azanium dichloride
Also Known As: Benzamidine, N'-(3,4-dichlorophenyl)-N-(p-(2-(diisopropylamino)ethoxy)phenyl)-, dihydrochloride, N'-(3,4-Dichlorophenyl)-N-(p-(2-(diisopropylamino)ethoxy)phenyl)benzamidine dihydrochloride, 2-[4-[(3,4-dichloroanilino)-phenylmethylidene]azaniumylphenoxy]ethyl-di(propan-2-yl)azanium dichloride, 2-[4-[[(3,4-DICHLOROPHENYL)AMINO]-PHENYL-METHYLIDENE]AZANIUMYLPHENOXY] ETHYL-DIPROPAN-2-YL-AZANIUM DICHLORIDE, 2-[4-[(3,4-dichloroanilino)-phenylmethylidene]azaniumylphenoxy]ethyl-di(propan-2-yl)azanium,dichloride
Technical Specifications
| Molecular Formula | C27H33Cl4N3O |
| Molecular Weight | 555.13776 g/mol |
| XLogP | -1.65 |
| Topological Polar Surface Area (TPSA) | 39.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 557.1348 Da |
| Heavy Atoms | 35 |
| Complexity | 578.0 |
| SMILES | CC(C)[NH+](CCOC1=CC=C(C=C1)[NH+]=C(C2=CC=CC=C2)NC3=CC(=C(C=C3)Cl)Cl)C(C)C.[Cl-].[Cl-] |
| InChIKey | QHXWQYAMOKQPQJ-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:322638
Property Insights of RefChem:322638
The XLogP value of -1.65 indicates that RefChem:322638 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 39.7 Ų, RefChem:322638 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:322638 has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:322638?
The CAS number of RefChem:322638 is 80785-16-6.
What is the molecular formula of RefChem:322638?
The molecular formula of RefChem:322638 is C27H33Cl4N3O.
What is the molecular weight of RefChem:322638?
The molecular weight of RefChem:322638 is 555.13776 g/mol.
Where can I buy RefChem:322638?
You can request a quote for RefChem:322638 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:322638?
Yes, CoreyChem provides custom synthesis services for RefChem:322638 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.