AN-655/13402057
TL;DR: AN-655/13402057 (CAS 353518-48-6) is a chemical compound with molecular formula C18H15N5O2S and molecular weight 365.09464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3-methylsulfanyl-6-pyridin-2-yl-6H-[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7-yl)ethanone
Also Known As: AN-655/13402057, 1-(3-methylsulfanyl-6-pyridin-2-yl-6H-[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7-yl)ethanone, 7-acetyl-3-(methylthio)-6-(2-pyridinyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine, 1-[3-(methylsulfanyl)-6-(pyridin-2-yl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethanone, 7-acetyl-6-(2-pyridinyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-3-yl methyl sulfide
Technical Specifications
| Molecular Formula | C18H15N5O2S |
| Molecular Weight | 365.09464 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 365.09464 Da |
| Heavy Atoms | 26 |
| Complexity | 510.0 |
| SMILES | CC(=O)N1C(OC2=C(C3=CC=CC=C31)N=NC(=N2)SC)C4=CC=CC=N4 |
| InChIKey | UHCQEWLKHYSNDX-UHFFFAOYSA-N |
Chemical Property Profile of AN-655/13402057
Property Insights of AN-655/13402057
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AN-655/13402057. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-655/13402057. Following Lipinski's Rule of Five, AN-655/13402057 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
What is the CAS number of AN-655/13402057?
The CAS number of AN-655/13402057 is 353518-48-6.
What is the molecular formula of AN-655/13402057?
The molecular formula of AN-655/13402057 is C18H15N5O2S.
What is the molecular weight of AN-655/13402057?
The molecular weight of AN-655/13402057 is 365.09464 g/mol.
Where can I buy AN-655/13402057?
You can request a quote for AN-655/13402057 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for AN-655/13402057?
Yes, CoreyChem provides custom synthesis services for AN-655/13402057 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.