AN-655/13672002
TL;DR: AN-655/13672002 (CAS 353519-38-7) is a chemical compound with molecular formula C23H22N4O5S and molecular weight 466.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(7-acetyl-3-ethylsulfanyl-6H-[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl)-2-methoxyphenyl] acetate
Also Known As: AN-655/13672002, 4-[7-acetyl-3-(ethylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl]-2-methoxyphenyl acetate, [4-(7-acetyl-3-ethylsulfanyl-6H-[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl)-2-methoxyphenyl] acetate, 4-(7-acetyl-3-(ethylthio)-6,7-dihydrobenzo[d][1,2,4]triazino[6,5-f][1,3]oxazepin-6-yl)-2-methoxyphenyl acetate
| Molecular Formula | C23H22N4O5S |
|---|---|
| Molecular Weight | 466.13 g/mol |
| LogP | 4.0286 |
| Topological Polar Surface Area | 103.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 466.1311 |
| Heavy Atoms | 33 |
| Complexity | 1219.2062 |
Chemical Identifiers
| CAS Number | 353519-38-7 |
|---|---|
| SMILES | CCSC1=NC2=C(C3=CC=CC=C3N(C(O2)C4=CC(=C(C=C4)OC(=O)C)OC)C(=O)C)N=N1 |
Product Overview
AN-655/13672002 (CAS 353519-38-7), with molecular formula C23H22N4O5S and molecular weight 466.13 g/mol. IUPAC: [4-(7-acetyl-3-ethylsulfanyl-6H-[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl)-2-methoxyphenyl] acetate.
Chemical Property Profile of AN-655/13672002
Property Insights of AN-655/13672002
The XLogP value of 4.0286 indicates that AN-655/13672002 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.74 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-655/13672002. Following Lipinski's Rule of Five, AN-655/13672002 has 0 hydrogen bond donor(s) and 9 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 AN-655/13672002?
The CAS number of AN-655/13672002 is 353519-38-7.
What is the molecular formula of AN-655/13672002?
The molecular formula of AN-655/13672002 is C23H22N4O5S.
What is the molecular weight of AN-655/13672002?
The molecular weight of AN-655/13672002 is 466.13 g/mol.
Where can I buy AN-655/13672002?
You can request a quote for AN-655/13672002 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-655/13672002?
Yes, KEHONG BIO provides custom synthesis services for AN-655/13672002 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.