1-Hydroxy-2-(isoquinolin-1-ylmethylideneamino)guanidine
TL;DR: 1-Hydroxy-2-(isoquinolin-1-ylmethylideneamino)guanidine (CAS 96826-68-5) is a chemical compound with molecular formula C11H11N5O and molecular weight 229.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hydroxy-2-(isoquinolin-1-ylmethylideneamino)guanidine
Also Known As: (1-Isoquinolinylmethylene)-N-hydroxy-N'-aminoguanidine, 1-hydroxy-2-(isoquinolin-1-ylmethylideneamino)guanidine
| Molecular Formula | C11H11N5O |
|---|---|
| Molecular Weight | 229.10 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 95.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 229.09636 |
| Heavy Atoms | 17 |
| Complexity | 304.0 |
Chemical Identifiers
| CAS Number | 96826-68-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CN=C2C=NN=C(N)NO |
| InChIKey | YQAKFHBZERDOAN-UHFFFAOYSA-N |
Product Overview
1-Hydroxy-2-(isoquinolin-1-ylmethylideneamino)guanidine (CAS 96826-68-5), with molecular formula C11H11N5O and molecular weight 229.10 g/mol. IUPAC: 1-hydroxy-2-(isoquinolin-1-ylmethylideneamino)guanidine.
Chemical Property Profile of 1-Hydroxy-2-(isoquinolin-1-ylmethylideneamino)guanidine
Property Insights of 1-Hydroxy-2-(isoquinolin-1-ylmethylideneamino)guanidine
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Hydroxy-2-(isoquinolin-1-ylmethylideneamino)guanidine. The TPSA of 95.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Hydroxy-2-(isoquinolin-1-ylmethylideneamino)guanidine. Following Lipinski's Rule of Five, 1-Hydroxy-2-(isoquinolin-1-ylmethylideneamino)guanidine has 3 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 1-Hydroxy-2-(isoquinolin-1-ylmethylideneamino)guanidine?
The CAS number of 1-Hydroxy-2-(isoquinolin-1-ylmethylideneamino)guanidine is 96826-68-5.
What is the molecular formula of 1-Hydroxy-2-(isoquinolin-1-ylmethylideneamino)guanidine?
The molecular formula of 1-Hydroxy-2-(isoquinolin-1-ylmethylideneamino)guanidine is C11H11N5O.
What is the molecular weight of 1-Hydroxy-2-(isoquinolin-1-ylmethylideneamino)guanidine?
The molecular weight of 1-Hydroxy-2-(isoquinolin-1-ylmethylideneamino)guanidine is 229.10 g/mol.
Where can I buy 1-Hydroxy-2-(isoquinolin-1-ylmethylideneamino)guanidine?
You can request a quote for 1-Hydroxy-2-(isoquinolin-1-ylmethylideneamino)guanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Hydroxy-2-(isoquinolin-1-ylmethylideneamino)guanidine?
Yes, KEHONG BIO provides custom synthesis services for 1-Hydroxy-2-(isoquinolin-1-ylmethylideneamino)guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.