TL;DR: RefChem:322665 (CAS 80785-09-7) is a chemical compound with molecular formula C28H37Cl2N3O2 and molecular weight 517.22626 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-[(4-methoxyanilino)-phenylmethylidene]azaniumylphenoxy]ethyl-di(propan-2-yl)azanium dichloride
Also Known As: Benzamidine, N-(p-(2-(diisopropylamino)ethoxy)phenyl)-N'-(p-methoxyphenyl)-, dihydrochloride, N-(p-(2-(Diisopropylamino)ethoxy)phenyl)-N'-(p-methoxyphenyl)benzamidine dihydrochloride, 2-[4-[(4-methoxyanilino)-phenylmethylidene]azaniumylphenoxy]ethyl-di(propan-2-yl)azanium dichloride
| Molecular Formula | C28H37Cl2N3O2 |
| Molecular Weight | 517.22626 g/mol |
| XLogP | -2.95 |
| Topological Polar Surface Area (TPSA) | 48.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 517.22626 Da |
| Heavy Atoms | 35 |
| Complexity | 549.0 |
| SMILES | CC(C)[NH+](CCOC1=CC=C(C=C1)[NH+]=C(C2=CC=CC=C2)NC3=CC=C(C=C3)OC)C(C)C.[Cl-].[Cl-] |
| InChIKey | SAPKLIKREWRSLO-UHFFFAOYSA-N |
The XLogP value of -2.95 indicates that RefChem:322665 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 48.9 Ų, RefChem:322665 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:322665 has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of RefChem:322665 is 80785-09-7.
The molecular formula of RefChem:322665 is C28H37Cl2N3O2.
The molecular weight of RefChem:322665 is 517.22626 g/mol.
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