C8H9ClN8
TL;DR: C8H9ClN8 (CAS 477852-41-8) is a chemical compound with molecular formula C8H9ClN8 and molecular weight 252.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[(6-chloropyridazin-3-yl)amino]-2-(1,2,4-triazol-1-yl)ethanimidamide
Also Known As: N'-(6-chloro-3-pyridazinyl)-2-(1H-1,2,4-triazol-1-yl)ethanimidohydrazide, N'-[(6-chloropyridazin-3-yl)amino]-2-(1,2,4-triazol-1-yl)ethanimidamide, N-[(6-chloropyridazin-3-yl)amino]-2-(1H-1,2,4-triazol-1-yl)ethanimidamide, N'-[(6-chloropyridazin-3-yl)amino]-2-(1,2,4-triazol-1-yl)acetamidine, C8H9ClN8
| Molecular Formula | C8H9ClN8 |
|---|---|
| Molecular Weight | 252.06 g/mol |
| LogP | 0.1058 |
| Topological Polar Surface Area | 106.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 252.06387 |
| Heavy Atoms | 17 |
| Complexity | 490.75354 |
Chemical Identifiers
| CAS Number | 477852-41-8 |
|---|---|
| SMILES | C1=CC(=NN=C1NN=C(CN2C=NC=N2)N)Cl |
Product Overview
C8H9ClN8 (CAS 477852-41-8), with molecular formula C8H9ClN8 and molecular weight 252.06 g/mol. IUPAC: N'-[(6-chloropyridazin-3-yl)amino]-2-(1,2,4-triazol-1-yl)ethanimidamide.
Chemical Property Profile of C8H9ClN8
Property Insights of C8H9ClN8
The XLogP value of 0.1058 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C8H9ClN8. The TPSA of 106.9 Ų falls within the moderate polarity range, balancing permeability and solubility for C8H9ClN8. Following Lipinski's Rule of Five, C8H9ClN8 has 2 hydrogen bond donor(s) and 6 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 C8H9ClN8?
The CAS number of C8H9ClN8 is 477852-41-8.
What is the molecular formula of C8H9ClN8?
The molecular formula of C8H9ClN8 is C8H9ClN8.
What is the molecular weight of C8H9ClN8?
The molecular weight of C8H9ClN8 is 252.06 g/mol.
Where can I buy C8H9ClN8?
You can request a quote for C8H9ClN8 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C8H9ClN8?
Yes, KEHONG BIO provides custom synthesis services for C8H9ClN8 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.