4,4'-(1,6-Hexanediyldiimino)bis(3-aminobenzenecarboximidamide)
TL;DR: 4,4'-(1,6-Hexanediyldiimino)bis(3-aminobenzenecarboximidamide) (CAS 125880-88-8) is a chemical compound with molecular formula C20H30N8 and molecular weight 382.25934 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-amino-4-[6-(2-amino-4-carbamimidoylanilino)hexylamino]benzenecarboximidamide
Also Known As: Pentamidine analog, 1,6-Di(4-amidino-2-aminophenylamino)hexane, 4,4'-(1,6-Hexanediyldiimino)bis(3-aminobenzenecarboximidamide), 4,4 -[1,6-Hexanediylbis(imino)]bis[3-aminobenzamidine], 3-amino-4-[6-(2-amino-4-carbamimidoylanilino)hexylamino]benzenecarboximidamide
Technical Specifications
| Molecular Formula | C20H30N8 |
| Molecular Weight | 382.25934 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 176.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 382.25934 Da |
| Heavy Atoms | 28 |
| Complexity | 453.0 |
| SMILES | C1=CC(=C(C=C1C(=N)N)N)NCCCCCCNC2=C(C=C(C=C2)C(=N)N)N |
| InChIKey | WHBMNMVYLUEXCI-UHFFFAOYSA-N |
Chemical Property Profile of 4,4'-(1,6-Hexanediyldiimino)bis(3-aminobenzenecarboximidamide)
Property Insights of 4,4'-(1,6-Hexanediyldiimino)bis(3-aminobenzenecarboximidamide)
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4'-(1,6-Hexanediyldiimino)bis(3-aminobenzenecarboximidamide). The TPSA of 176.0 Ų indicates high polarity, suggesting 4,4'-(1,6-Hexanediyldiimino)bis(3-aminobenzenecarboximidamide) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4,4'-(1,6-Hexanediyldiimino)bis(3-aminobenzenecarboximidamide) has 8 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 4,4'-(1,6-Hexanediyldiimino)bis(3-aminobenzenecarboximidamide)?
The CAS number of 4,4'-(1,6-Hexanediyldiimino)bis(3-aminobenzenecarboximidamide) is 125880-88-8.
What is the molecular formula of 4,4'-(1,6-Hexanediyldiimino)bis(3-aminobenzenecarboximidamide)?
The molecular formula of 4,4'-(1,6-Hexanediyldiimino)bis(3-aminobenzenecarboximidamide) is C20H30N8.
What is the molecular weight of 4,4'-(1,6-Hexanediyldiimino)bis(3-aminobenzenecarboximidamide)?
The molecular weight of 4,4'-(1,6-Hexanediyldiimino)bis(3-aminobenzenecarboximidamide) is 382.25934 g/mol.
Where can I buy 4,4'-(1,6-Hexanediyldiimino)bis(3-aminobenzenecarboximidamide)?
You can request a quote for 4,4'-(1,6-Hexanediyldiimino)bis(3-aminobenzenecarboximidamide) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4,4'-(1,6-Hexanediyldiimino)bis(3-aminobenzenecarboximidamide)?
Yes, CoreyChem provides custom synthesis services for 4,4'-(1,6-Hexanediyldiimino)bis(3-aminobenzenecarboximidamide) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.