TL;DR: 3,3'-(1,6-Hexanediylbis(oxy))bis-benzenecarboximidamide (CAS 121324-51-4) is a chemical compound with molecular formula C20H26N4O2 and molecular weight 354.20557 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[6-(3-carbamimidoylphenoxy)hexoxy]benzenecarboximidamide
Also Known As: Pentamidine analog, 1,6-Di(3-amidinophenoxy)hexane, 3,3'-(1,6-Hexanediylbis(oxy))bis-benzenecarboximidamide, 3-[6-(3-carbamimidoylphenoxy)hexoxy]benzamidine, 3,3 -[1,6-Hexanediylbis(oxy)]bis[benzamidine]
| Molecular Formula | C20H26N4O2 |
| Molecular Weight | 354.20557 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 118.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 354.20557 Da |
| Heavy Atoms | 26 |
| Complexity | 404.0 |
| SMILES | C1=CC(=CC(=C1)OCCCCCCOC2=CC=CC(=C2)C(=N)N)C(=N)N |
| InChIKey | VHMMXGSRKCGGJH-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3'-(1,6-Hexanediylbis(oxy))bis-benzenecarboximidamide. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3'-(1,6-Hexanediylbis(oxy))bis-benzenecarboximidamide. Following Lipinski's Rule of Five, 3,3'-(1,6-Hexanediylbis(oxy))bis-benzenecarboximidamide has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3,3'-(1,6-Hexanediylbis(oxy))bis-benzenecarboximidamide is 121324-51-4.
The molecular formula of 3,3'-(1,6-Hexanediylbis(oxy))bis-benzenecarboximidamide is C20H26N4O2.
The molecular weight of 3,3'-(1,6-Hexanediylbis(oxy))bis-benzenecarboximidamide is 354.20557 g/mol.
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