4,4'-(1,5-Pentanediylbis(oxy))bis(3-methoxybenzenecarboximidamide)
TL;DR: 4,4'-(1,5-Pentanediylbis(oxy))bis(3-methoxybenzenecarboximidamide) (CAS 124076-64-8) is a chemical compound with molecular formula C21H28N4O4 and molecular weight 400.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[5-(4-carbamimidoyl-2-methoxyphenoxy)pentoxy]-3-methoxybenzenecarboximidamide
Also Known As: Pentamidine analog, 1,5-Di(4-amidino-2-methoxy)pentane, 4,4'-(1,5-Pentanediylbis(oxy))bis(3-methoxybenzenecarboximidamide), 4,4 -[1,5-Pentanediylbis(oxy)]bis[3-methoxybenzamidine], 4,4'-[Pentane-1,5-diylbis(oxy)]bis(3-methoxybenzene-1-carboximidamide)
| Molecular Formula | C21H28N4O4 |
|---|---|
| Molecular Weight | 400.21 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 137.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 400.21106 |
| Heavy Atoms | 29 |
| Complexity | 475.0 |
Chemical Identifiers
| CAS Number | 124076-64-8 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C(=N)N)OCCCCCOC2=C(C=C(C=C2)C(=N)N)OC |
| InChIKey | TYWWXLGHQBRSIH-UHFFFAOYSA-N |
Product Overview
4,4'-(1,5-Pentanediylbis(oxy))bis(3-methoxybenzenecarboximidamide) (CAS 124076-64-8), with molecular formula C21H28N4O4 and molecular weight 400.21 g/mol. IUPAC: 4-[5-(4-carbamimidoyl-2-methoxyphenoxy)pentoxy]-3-methoxybenzenecarboximidamide.
Chemical Property Profile of 4,4'-(1,5-Pentanediylbis(oxy))bis(3-methoxybenzenecarboximidamide)
Property Insights of 4,4'-(1,5-Pentanediylbis(oxy))bis(3-methoxybenzenecarboximidamide)
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4'-(1,5-Pentanediylbis(oxy))bis(3-methoxybenzenecarboximidamide). The TPSA of 137.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,4'-(1,5-Pentanediylbis(oxy))bis(3-methoxybenzenecarboximidamide). Following Lipinski's Rule of Five, 4,4'-(1,5-Pentanediylbis(oxy))bis(3-methoxybenzenecarboximidamide) has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,4'-(1,5-Pentanediylbis(oxy))bis(3-methoxybenzenecarboximidamide)?
The CAS number of 4,4'-(1,5-Pentanediylbis(oxy))bis(3-methoxybenzenecarboximidamide) is 124076-64-8.
What is the molecular formula of 4,4'-(1,5-Pentanediylbis(oxy))bis(3-methoxybenzenecarboximidamide)?
The molecular formula of 4,4'-(1,5-Pentanediylbis(oxy))bis(3-methoxybenzenecarboximidamide) is C21H28N4O4.
What is the molecular weight of 4,4'-(1,5-Pentanediylbis(oxy))bis(3-methoxybenzenecarboximidamide)?
The molecular weight of 4,4'-(1,5-Pentanediylbis(oxy))bis(3-methoxybenzenecarboximidamide) is 400.21 g/mol.
Where can I buy 4,4'-(1,5-Pentanediylbis(oxy))bis(3-methoxybenzenecarboximidamide)?
You can request a quote for 4,4'-(1,5-Pentanediylbis(oxy))bis(3-methoxybenzenecarboximidamide) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-(1,5-Pentanediylbis(oxy))bis(3-methoxybenzenecarboximidamide)?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-(1,5-Pentanediylbis(oxy))bis(3-methoxybenzenecarboximidamide) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.