VU0494625-1
TL;DR: VU0494625-1 (CAS 873002-84-7) is a chemical compound with molecular formula C21H26N6O and molecular weight 378.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[6-(azepan-1-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]ethyl]-4-methylbenzamide
Also Known As: VU0494625-1, N-{2-[6-(azepan-1-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]ethyl}-4-methylbenzamide, N-(2-(6-(azepan-1-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)ethyl)-4-methylbenzamide, N-[2-[6-(azepan-1-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]ethyl]-4-methylbenzamide, N-{2-[5-(1-azepanyl)-1,2,3a,4-tetraaza-3-indenyl]ethyl}-p-toluamide
| Molecular Formula | C21H26N6O |
|---|---|
| Molecular Weight | 378.22 g/mol |
| LogP | 2.78562 |
| Topological Polar Surface Area | 75.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 378.2168 |
| Heavy Atoms | 28 |
| Complexity | 941.18915 |
Chemical Identifiers
| CAS Number | 873002-84-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NCCC2=NN=C3N2N=C(C=C3)N4CCCCCC4 |
Product Overview
VU0494625-1 (CAS 873002-84-7), with molecular formula C21H26N6O and molecular weight 378.22 g/mol. IUPAC: N-[2-[6-(azepan-1-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]ethyl]-4-methylbenzamide.
Chemical Property Profile of VU0494625-1
Property Insights of VU0494625-1
The XLogP value of 2.78562 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0494625-1. The TPSA of 75.42 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0494625-1. Following Lipinski's Rule of Five, VU0494625-1 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 VU0494625-1?
The CAS number of VU0494625-1 is 873002-84-7.
What is the molecular formula of VU0494625-1?
The molecular formula of VU0494625-1 is C21H26N6O.
What is the molecular weight of VU0494625-1?
The molecular weight of VU0494625-1 is 378.22 g/mol.
Where can I buy VU0494625-1?
You can request a quote for VU0494625-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0494625-1?
Yes, KEHONG BIO provides custom synthesis services for VU0494625-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.