N,3,4-三羟基苯甲脒
TL;DR: N,3,4-三羟基苯甲脒 (CAS 95933-72-5) is a chemical compound with molecular formula C7H8N2O3 and molecular weight 168.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,3,4-三羟基苯甲脒
N',3,4-trihydroxybenzenecarboximidamide
Also Known As: Amidox, N,3,4-Trihydroxybenzimidamide, 3,4-Dihydroxybenzamidoxime, N',3,4-trihydroxybenzamidine, Benzenecarboximidamide, N,3,4-trihydroxy-
| Molecular Formula | C7H8N2O3 |
|---|---|
| Molecular Weight | 168.05 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 99.1 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 168.0535 |
| Heavy Atoms | 12 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 95933-72-5 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(=NO)N)O)O |
| InChIKey | JOAASNKBYBFGDN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,3,4-三羟基苯甲脒 (CAS 95933-72-5), with molecular formula C7H8N2O3 and molecular weight 168.05 g/mol. IUPAC: N',3,4-trihydroxybenzenecarboximidamide.
Chemical Property Profile of N,3,4-三羟基苯甲脒
Property Insights of N,3,4-三羟基苯甲脒
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,3,4-三羟基苯甲脒. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for N,3,4-三羟基苯甲脒. Following Lipinski's Rule of Five, N,3,4-三羟基苯甲脒 has 4 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 N,3,4-三羟基苯甲脒?
The CAS number of N,3,4-三羟基苯甲脒 is 95933-72-5.
What is the molecular formula of N,3,4-三羟基苯甲脒?
The molecular formula of N,3,4-三羟基苯甲脒 is C7H8N2O3.
What is the molecular weight of N,3,4-三羟基苯甲脒?
The molecular weight of N,3,4-三羟基苯甲脒 is 168.05 g/mol.
Where can I buy N,3,4-三羟基苯甲脒?
You can request a quote for N,3,4-三羟基苯甲脒 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,3,4-三羟基苯甲脒?
Yes, KEHONG BIO provides custom synthesis services for N,3,4-三羟基苯甲脒 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.