AB00106466-01
TL;DR: AB00106466-01 (CAS 353518-54-4) is a chemical compound with molecular formula C17H14N4O2S2 and molecular weight 370.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-methylsulfanyl-6-thiophen-2-yl-6H-[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7-yl)ethanone
Also Known As: AB00106466-01, AN-655/13402064, 1-(3-methylsulfanyl-6-thiophen-2-yl-6H-[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7-yl)ethanone, 1-[3-(METHYLSULFANYL)-6-(2-THIENYL)[1,2,4]TRIAZINO[5,6-D][3,1]BENZOXAZEPIN-7(6H)-YL]-1-ETHANONE, 1-[3-(methylsulfanyl)-6-(thiophen-2-yl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethanone
| Molecular Formula | C17H14N4O2S2 |
|---|---|
| Molecular Weight | 370.06 g/mol |
| LogP | 3.7661 |
| Topological Polar Surface Area | 68.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 370.05582 |
| Heavy Atoms | 25 |
| Complexity | 930.1571 |
Chemical Identifiers
| CAS Number | 353518-54-4 |
|---|---|
| SMILES | CC(=O)N1C(OC2=C(C3=CC=CC=C31)N=NC(=N2)SC)C4=CC=CS4 |
Product Overview
AB00106466-01 (CAS 353518-54-4), with molecular formula C17H14N4O2S2 and molecular weight 370.06 g/mol. IUPAC: 1-(3-methylsulfanyl-6-thiophen-2-yl-6H-[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7-yl)ethanone.
Chemical Property Profile of AB00106466-01
Property Insights of AB00106466-01
The XLogP value of 3.7661 indicates that AB00106466-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.21 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00106466-01. Following Lipinski's Rule of Five, AB00106466-01 has 0 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 AB00106466-01?
The CAS number of AB00106466-01 is 353518-54-4.
What is the molecular formula of AB00106466-01?
The molecular formula of AB00106466-01 is C17H14N4O2S2.
What is the molecular weight of AB00106466-01?
The molecular weight of AB00106466-01 is 370.06 g/mol.
Where can I buy AB00106466-01?
You can request a quote for AB00106466-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00106466-01?
Yes, KEHONG BIO provides custom synthesis services for AB00106466-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.