AB00687505-01
TL;DR: AB00687505-01 (CAS 891114-30-0) is a chemical compound with molecular formula C17H11ClN6O and molecular weight 350.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-N-[3-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)phenyl]pyridine-3-carboxamide
Also Known As: AB00687505-01, F2508-0057, 6-chloro-N-(3-{[1,2,4]triazolo[4,3-b]pyridazin-6-yl}phenyl)pyridine-3-carboxamide, N-(3-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)phenyl)-6-chloronicotinamide, 6-chloro-N-[3-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)phenyl]pyridine-3-carboxamide
| Molecular Formula | C17H11ClN6O |
|---|---|
| Molecular Weight | 350.07 g/mol |
| LogP | 3.092 |
| Topological Polar Surface Area | 85.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 350.0683 |
| Heavy Atoms | 25 |
| Complexity | 1060.1318 |
Chemical Identifiers
| CAS Number | 891114-30-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC(=O)C2=CN=C(C=C2)Cl)C3=NN4C=NN=C4C=C3 |
Product Overview
AB00687505-01 (CAS 891114-30-0), with molecular formula C17H11ClN6O and molecular weight 350.07 g/mol. IUPAC: 6-chloro-N-[3-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)phenyl]pyridine-3-carboxamide.
Chemical Property Profile of AB00687505-01
Property Insights of AB00687505-01
The XLogP value of 3.092 indicates that AB00687505-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.07 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00687505-01. Following Lipinski's Rule of Five, AB00687505-01 has 1 hydrogen bond donor(s) and 5 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 AB00687505-01?
The CAS number of AB00687505-01 is 891114-30-0.
What is the molecular formula of AB00687505-01?
The molecular formula of AB00687505-01 is C17H11ClN6O.
What is the molecular weight of AB00687505-01?
The molecular weight of AB00687505-01 is 350.07 g/mol.
Where can I buy AB00687505-01?
You can request a quote for AB00687505-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00687505-01?
Yes, KEHONG BIO provides custom synthesis services for AB00687505-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.