3-吡啶基吡那地尔
TL;DR: 3-吡啶基吡那地尔 (CAS 60560-07-8) is a chemical compound with molecular formula C13H19N5 and molecular weight 245.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-吡啶基吡那地尔
1-cyano-2-(3,3-dimethylbutan-2-yl)-3-pyridin-3-ylguanidine
Also Known As: 3-Pyridyl pinacidil, 3-Pyridylpinacidil, 2-Cyano-3-(3-pyridyl)-1-(1,2,2-trimethylpropyl)guanidine, 1-cyano-2-(3,3-dimethylbutan-2-yl)-3-pyridin-3-ylguanidine, N''-cyano-N-3-pyridyl-N'-1,2,2-trimethylpropylguanidine
| Molecular Formula | C13H19N5 |
|---|---|
| Molecular Weight | 245.16 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 73.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 245.16405 |
| Heavy Atoms | 18 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 60560-07-8 |
|---|---|
| SMILES | CC(C(C)(C)C)N=C(NC#N)NC1=CN=CC=C1 |
| InChIKey | YJCUMRGFIIKHFP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-吡啶基吡那地尔 (CAS 60560-07-8), with molecular formula C13H19N5 and molecular weight 245.16 g/mol. IUPAC: 1-cyano-2-(3,3-dimethylbutan-2-yl)-3-pyridin-3-ylguanidine.
Chemical Property Profile of 3-吡啶基吡那地尔
Property Insights of 3-吡啶基吡那地尔
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-吡啶基吡那地尔. The TPSA of 73.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-吡啶基吡那地尔. Following Lipinski's Rule of Five, 3-吡啶基吡那地尔 has 2 hydrogen bond donor(s) and 3 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 3-吡啶基吡那地尔?
The CAS number of 3-吡啶基吡那地尔 is 60560-07-8.
What is the molecular formula of 3-吡啶基吡那地尔?
The molecular formula of 3-吡啶基吡那地尔 is C13H19N5.
What is the molecular weight of 3-吡啶基吡那地尔?
The molecular weight of 3-吡啶基吡那地尔 is 245.16 g/mol.
Where can I buy 3-吡啶基吡那地尔?
You can request a quote for 3-吡啶基吡那地尔 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-吡啶基吡那地尔?
Yes, KEHONG BIO provides custom synthesis services for 3-吡啶基吡那地尔 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.