F2007-0455
TL;DR: F2007-0455 (CAS 897759-03-4) is a chemical compound with molecular formula C18H18FN5O3S and molecular weight 403.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[3-[2-[(4-fluorobenzoyl)amino]ethyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]acetate
Also Known As: F2007-0455, ethyl 2-[(3-{2-[(4-fluorophenyl)formamido]ethyl}-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acetate, ethyl 2-((3-(2-(4-fluorobenzamido)ethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)thio)acetate, ethyl 2-[[3-[2-[(4-fluorobenzoyl)amino]ethyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]acetate
| Molecular Formula | C18H18FN5O3S |
|---|---|
| Molecular Weight | 403.11 g/mol |
| LogP | 1.8911 |
| Topological Polar Surface Area | 98.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 403.11145 |
| Heavy Atoms | 28 |
| Complexity | 977.0165 |
Chemical Identifiers
| CAS Number | 897759-03-4 |
|---|---|
| SMILES | CCOC(=O)CSC1=NN2C(=NN=C2CCNC(=O)C3=CC=C(C=C3)F)C=C1 |
Product Overview
F2007-0455 (CAS 897759-03-4), with molecular formula C18H18FN5O3S and molecular weight 403.11 g/mol. IUPAC: ethyl 2-[[3-[2-[(4-fluorobenzoyl)amino]ethyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]acetate.
Chemical Property Profile of F2007-0455
Property Insights of F2007-0455
The XLogP value of 1.8911 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F2007-0455. The TPSA of 98.48 Ų falls within the moderate polarity range, balancing permeability and solubility for F2007-0455. Following Lipinski's Rule of Five, F2007-0455 has 1 hydrogen bond donor(s) and 7 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 F2007-0455?
The CAS number of F2007-0455 is 897759-03-4.
What is the molecular formula of F2007-0455?
The molecular formula of F2007-0455 is C18H18FN5O3S.
What is the molecular weight of F2007-0455?
The molecular weight of F2007-0455 is 403.11 g/mol.
Where can I buy F2007-0455?
You can request a quote for F2007-0455 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2007-0455?
Yes, KEHONG BIO provides custom synthesis services for F2007-0455 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.