AMS_CNC_ID-40794503
TL;DR: AMS_CNC_ID-40794503 (CAS 868968-29-0) is a chemical compound with molecular formula C16H15N5O3S and molecular weight 357.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-oxo-4-[(3-pyridin-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]butanoate
Also Known As: AMS_CNC_ID-40794503, ethyl 3-oxo-4-((3-(pyridin-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)thio)butanoate, F1835-0237, ethyl 3-oxo-4-[(3-pyridin-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]butanoate, ethyl 3-oxo-4-{[3-(pyridin-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}butanoate
| Molecular Formula | C16H15N5O3S |
|---|---|
| Molecular Weight | 357.09 g/mol |
| LogP | 1.8007 |
| Topological Polar Surface Area | 99.34 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 357.08957 |
| Heavy Atoms | 25 |
| Complexity | 897.1814 |
Chemical Identifiers
| CAS Number | 868968-29-0 |
|---|---|
| SMILES | CCOC(=O)CC(=O)CSC1=NN2C(=NN=C2C3=CC=CC=N3)C=C1 |
Product Overview
AMS_CNC_ID-40794503 (CAS 868968-29-0), with molecular formula C16H15N5O3S and molecular weight 357.09 g/mol. IUPAC: ethyl 3-oxo-4-[(3-pyridin-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]butanoate.
Chemical Property Profile of AMS_CNC_ID-40794503
Property Insights of AMS_CNC_ID-40794503
The XLogP value of 1.8007 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AMS_CNC_ID-40794503. The TPSA of 99.34 Ų falls within the moderate polarity range, balancing permeability and solubility for AMS_CNC_ID-40794503. Following Lipinski's Rule of Five, AMS_CNC_ID-40794503 has 0 hydrogen bond donor(s) and 8 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 AMS_CNC_ID-40794503?
The CAS number of AMS_CNC_ID-40794503 is 868968-29-0.
What is the molecular formula of AMS_CNC_ID-40794503?
The molecular formula of AMS_CNC_ID-40794503 is C16H15N5O3S.
What is the molecular weight of AMS_CNC_ID-40794503?
The molecular weight of AMS_CNC_ID-40794503 is 357.09 g/mol.
Where can I buy AMS_CNC_ID-40794503?
You can request a quote for AMS_CNC_ID-40794503 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AMS_CNC_ID-40794503?
Yes, KEHONG BIO provides custom synthesis services for AMS_CNC_ID-40794503 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.