CyanoIrbesartan
TL;DR: CyanoIrbesartan (CAS 138401-24-8) is a chemical compound with molecular formula C25H27N3O and molecular weight 385.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(2-butyl-4-oxo-1,3-diazaspiro[4.4]non-1-en-3-yl)methyl]phenyl]benzonitrile
Also Known As: CyanoIrbesartan, Irbesartan Impurity 7, Irbesartan Cyano Impurity, Irbesartan Impurity B, 4'-((2-Butyl-4-oxo-1,3-diazaspiro[4.4]non-1-en-3-yl)methyl)-[1,1'-biphenyl]-2-carbonitrile
| Molecular Formula | C25H27N3O |
|---|---|
| Molecular Weight | 385.22 g/mol |
| LogP | 5.46898 |
| Topological Polar Surface Area | 56.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 385.21542 |
| Heavy Atoms | 29 |
| Complexity | 962.30817 |
Chemical Identifiers
| CAS Number | 138401-24-8 |
|---|---|
| SMILES | CCCCC1=NC2(CCCC2)C(=O)N1CC3=CC=C(C=C3)C4=CC=CC=C4C#N |
Product Overview
CyanoIrbesartan (CAS 138401-24-8), with molecular formula C25H27N3O and molecular weight 385.22 g/mol. IUPAC: 2-[4-[(2-butyl-4-oxo-1,3-diazaspiro[4.4]non-1-en-3-yl)methyl]phenyl]benzonitrile.
Chemical Property Profile of CyanoIrbesartan
Property Insights of CyanoIrbesartan
The XLogP value of 5.46898 indicates that CyanoIrbesartan is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.46 Ų, CyanoIrbesartan exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CyanoIrbesartan has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CyanoIrbesartan?
The CAS number of CyanoIrbesartan is 138401-24-8.
What is the molecular formula of CyanoIrbesartan?
The molecular formula of CyanoIrbesartan is C25H27N3O.
What is the molecular weight of CyanoIrbesartan?
The molecular weight of CyanoIrbesartan is 385.22 g/mol.
Where can I buy CyanoIrbesartan?
You can request a quote for CyanoIrbesartan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CyanoIrbesartan?
Yes, KEHONG BIO provides custom synthesis services for CyanoIrbesartan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.