4,4'-(1,5-Pentanediylbis(oxy))bis(3-nitrobenzenecarboximidamide)
TL;DR: 4,4'-(1,5-Pentanediylbis(oxy))bis(3-nitrobenzenecarboximidamide) (CAS 125901-98-6) is a chemical compound with molecular formula C19H22N6O6 and molecular weight 430.1601 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[5-(4-carbamimidoyl-2-nitrophenoxy)pentoxy]-3-nitrobenzenecarboximidamide
Also Known As: Pentamidine analog, 1,5-Di(4-amidino-2-nitrophenoxy)pentane, 4,4'-(1,5-Pentanediylbis(oxy))bis(3-nitrobenzenecarboximidamide), 4-[5-(4-carbamimidoyl-2-nitrophenoxy)pentoxy]-3-nitrobenzenecarboximidamide, 4,4 -[1,5-Pentanediylbis(oxy)]bis[3-nitrobenzamidine]
Technical Specifications
| Molecular Formula | C19H22N6O6 |
| Molecular Weight | 430.1601 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 210.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 430.1601 Da |
| Heavy Atoms | 31 |
| Complexity | 597.0 |
| SMILES | C1=CC(=C(C=C1C(=N)N)[N+](=O)[O-])OCCCCCOC2=C(C=C(C=C2)C(=N)N)[N+](=O)[O-] |
| InChIKey | QGYJOIDDJBUEBL-UHFFFAOYSA-N |
Chemical Property Profile of 4,4'-(1,5-Pentanediylbis(oxy))bis(3-nitrobenzenecarboximidamide)
Property Insights of 4,4'-(1,5-Pentanediylbis(oxy))bis(3-nitrobenzenecarboximidamide)
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4'-(1,5-Pentanediylbis(oxy))bis(3-nitrobenzenecarboximidamide). The TPSA of 210.0 Ų indicates high polarity, suggesting 4,4'-(1,5-Pentanediylbis(oxy))bis(3-nitrobenzenecarboximidamide) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4,4'-(1,5-Pentanediylbis(oxy))bis(3-nitrobenzenecarboximidamide) has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4,4'-(1,5-Pentanediylbis(oxy))bis(3-nitrobenzenecarboximidamide)?
The CAS number of 4,4'-(1,5-Pentanediylbis(oxy))bis(3-nitrobenzenecarboximidamide) is 125901-98-6.
What is the molecular formula of 4,4'-(1,5-Pentanediylbis(oxy))bis(3-nitrobenzenecarboximidamide)?
The molecular formula of 4,4'-(1,5-Pentanediylbis(oxy))bis(3-nitrobenzenecarboximidamide) is C19H22N6O6.
What is the molecular weight of 4,4'-(1,5-Pentanediylbis(oxy))bis(3-nitrobenzenecarboximidamide)?
The molecular weight of 4,4'-(1,5-Pentanediylbis(oxy))bis(3-nitrobenzenecarboximidamide) is 430.1601 g/mol.
Where can I buy 4,4'-(1,5-Pentanediylbis(oxy))bis(3-nitrobenzenecarboximidamide)?
You can request a quote for 4,4'-(1,5-Pentanediylbis(oxy))bis(3-nitrobenzenecarboximidamide) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4,4'-(1,5-Pentanediylbis(oxy))bis(3-nitrobenzenecarboximidamide)?
Yes, CoreyChem provides custom synthesis services for 4,4'-(1,5-Pentanediylbis(oxy))bis(3-nitrobenzenecarboximidamide) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.