Ruscopine
TL;DR: Ruscopine (CAS 3912-65-0) is a chemical compound with molecular formula C16H26N4O2 and molecular weight 306.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[6-(aminomethylideneamino)-1-(3,4-dimethoxyphenyl)hexan-3-yl]methanimidamide
Also Known As: Ruscopine, N'-[6-(aminomethylideneamino)-1-(3,4-dimethoxyphenyl)hexan-3-yl]methanimidamide, N',N'''-[6-(3,4-Dimethoxyphenyl)hexane-1,4-diyl]dimethanimidamide, 1-(3,4-Dimethoxyphenethyl)-N,N -bis(iminomethyl)-1,4-butanediamine, N-[1-(3,4-dimethoxyphenyl)-6-methanimidamidohexan-3-yl]methanimidamide
| Molecular Formula | C16H26N4O2 |
|---|---|
| Molecular Weight | 306.21 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 95.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 306.20557 |
| Heavy Atoms | 22 |
| Complexity | 336.0 |
Chemical Identifiers
| CAS Number | 3912-65-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCC(CCCN=CN)N=CN)OC |
| InChIKey | JVNVHIPXYJPRRV-UHFFFAOYSA-N |
Product Overview
Ruscopine (CAS 3912-65-0), with molecular formula C16H26N4O2 and molecular weight 306.21 g/mol. IUPAC: N'-[6-(aminomethylideneamino)-1-(3,4-dimethoxyphenyl)hexan-3-yl]methanimidamide.
Chemical Property Profile of Ruscopine
Property Insights of Ruscopine
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ruscopine. The TPSA of 95.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Ruscopine. Following Lipinski's Rule of Five, Ruscopine has 2 hydrogen bond donor(s) and 4 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 Ruscopine?
The CAS number of Ruscopine is 3912-65-0.
What is the molecular formula of Ruscopine?
The molecular formula of Ruscopine is C16H26N4O2.
What is the molecular weight of Ruscopine?
The molecular weight of Ruscopine is 306.21 g/mol.
Where can I buy Ruscopine?
You can request a quote for Ruscopine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ruscopine?
Yes, KEHONG BIO provides custom synthesis services for Ruscopine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.