Propanedinitrile, (1-(2-(((5-((3-methoxy-1-piperidinyl)methyl)-2-furanyl)methyl)amino)ethyl)-2-imidazolidinylidene)-, dihydrochloride
TL;DR: Propanedinitrile, (1-(2-(((5-((3-methoxy-1-piperidinyl)methyl)-2-furanyl)methyl)amino)ethyl)-2-imidazolidinylidene)-, dihydrochloride (CAS 135017-89-9) is a chemical compound with molecular formula C20H30Cl2N6O2 and molecular weight 456.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-[2-[[5-[(3-methoxypiperidin-1-yl)methyl]furan-2-yl]methylamino]ethyl]imidazolidin-2-ylidene]propanedinitrile;dihydrochloride
Also Known As: Propanedinitrile, (1-(2-(((5-((3-methoxy-1-piperidinyl)methyl)-2-furanyl)methyl)amino)ethyl)-2-imidazolidinylidene)-, dihydrochloride, (1-{2-[({5-[(3-Methoxypiperidin-1-yl)methyl]furan-2-yl}methyl)amino]ethyl}imidazolidin-2-ylidene)propanedinitrile--hydrogen chloride (1/2), 2-[1-[2-[[5-[(3-methoxypiperidin-1-yl)methyl]furan-2-yl]methylamino]ethyl]imidazolidin-2-ylidene]propanedinitrile dihydrochloride, RefChem:374382
| Molecular Formula | C20H30Cl2N6O2 |
|---|---|
| Molecular Weight | 456.18 g/mol |
| LogP | 1.98756 |
| Topological Polar Surface Area | 100.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 456.18073 |
| Heavy Atoms | 30 |
| Complexity | 754.0816 |
Chemical Identifiers
| CAS Number | 135017-89-9 |
|---|---|
| SMILES | COC1CCCN(C1)CC2=CC=C(O2)CNCCN3CCNC3=C(C#N)C#N.Cl.Cl |
Product Overview
Propanedinitrile, (1-(2-(((5-((3-methoxy-1-piperidinyl)methyl)-2-furanyl)methyl)amino)ethyl)-2-imidazolidinylidene)-, dihydrochloride (CAS 135017-89-9), with molecular formula C20H30Cl2N6O2 and molecular weight 456.18 g/mol. IUPAC: 2-[1-[2-[[5-[(3-methoxypiperidin-1-yl)methyl]furan-2-yl]methylamino]ethyl]imidazolidin-2-ylidene]propanedinitrile;dihydrochloride.
Chemical Property Profile of Propanedinitrile, (1-(2-(((5-((3-methoxy-1-piperidinyl)methyl)-2-furanyl)methyl)amino)ethyl)-2-imidazolidinylidene)-, dihydrochloride
Property Insights of Propanedinitrile, (1-(2-(((5-((3-methoxy-1-piperidinyl)methyl)-2-furanyl)methyl)amino)ethyl)-2-imidazolidinylidene)-, dihydrochloride
The XLogP value of 1.98756 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propanedinitrile, (1-(2-(((5-((3-methoxy-1-piperidinyl)methyl)-2-furanyl)methyl)amino)ethyl)-2-imidazolidinylidene)-, dihydrochloride. The TPSA of 100.49 Ų falls within the moderate polarity range, balancing permeability and solubility for Propanedinitrile, (1-(2-(((5-((3-methoxy-1-piperidinyl)methyl)-2-furanyl)methyl)amino)ethyl)-2-imidazolidinylidene)-, dihydrochloride. Following Lipinski's Rule of Five, Propanedinitrile, (1-(2-(((5-((3-methoxy-1-piperidinyl)methyl)-2-furanyl)methyl)amino)ethyl)-2-imidazolidinylidene)-, dihydrochloride has 2 hydrogen bond donor(s) and 8 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 Propanedinitrile, (1-(2-(((5-((3-methoxy-1-piperidinyl)methyl)-2-furanyl)methyl)amino)ethyl)-2-imidazolidinylidene)-, dihydrochloride?
The CAS number of Propanedinitrile, (1-(2-(((5-((3-methoxy-1-piperidinyl)methyl)-2-furanyl)methyl)amino)ethyl)-2-imidazolidinylidene)-, dihydrochloride is 135017-89-9.
What is the molecular formula of Propanedinitrile, (1-(2-(((5-((3-methoxy-1-piperidinyl)methyl)-2-furanyl)methyl)amino)ethyl)-2-imidazolidinylidene)-, dihydrochloride?
The molecular formula of Propanedinitrile, (1-(2-(((5-((3-methoxy-1-piperidinyl)methyl)-2-furanyl)methyl)amino)ethyl)-2-imidazolidinylidene)-, dihydrochloride is C20H30Cl2N6O2.
What is the molecular weight of Propanedinitrile, (1-(2-(((5-((3-methoxy-1-piperidinyl)methyl)-2-furanyl)methyl)amino)ethyl)-2-imidazolidinylidene)-, dihydrochloride?
The molecular weight of Propanedinitrile, (1-(2-(((5-((3-methoxy-1-piperidinyl)methyl)-2-furanyl)methyl)amino)ethyl)-2-imidazolidinylidene)-, dihydrochloride is 456.18 g/mol.
Where can I buy Propanedinitrile, (1-(2-(((5-((3-methoxy-1-piperidinyl)methyl)-2-furanyl)methyl)amino)ethyl)-2-imidazolidinylidene)-, dihydrochloride?
You can request a quote for Propanedinitrile, (1-(2-(((5-((3-methoxy-1-piperidinyl)methyl)-2-furanyl)methyl)amino)ethyl)-2-imidazolidinylidene)-, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanedinitrile, (1-(2-(((5-((3-methoxy-1-piperidinyl)methyl)-2-furanyl)methyl)amino)ethyl)-2-imidazolidinylidene)-, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Propanedinitrile, (1-(2-(((5-((3-methoxy-1-piperidinyl)methyl)-2-furanyl)methyl)amino)ethyl)-2-imidazolidinylidene)-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.