AN-655/14023030
TL;DR: AN-655/14023030 (CAS 354777-40-5) is a chemical compound with molecular formula C21H19ClN4O2S and molecular weight 426.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[6-(3-chlorophenyl)-3-propylsulfanyl-6H-[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7-yl]ethanone
Also Known As: AN-655/14023030, 1-[6-(3-chlorophenyl)-3-propylsulfanyl-6H-[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7-yl]ethanone, 1-[6-(3-chlorophenyl)-3-(propylsulfanyl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethanone, 1-[6-(3-CHLOROPHENYL)-3-(PROPYLSULFANYL)[1,2,4]TRIAZINO[5,6-D][3,1]BENZOXAZEPIN-7(6H)-YL]-1-ETHANONE, 7-acetyl-6-(3-chlorophenyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-3-yl propyl sulfide
| Molecular Formula | C21H19ClN4O2S |
|---|---|
| Molecular Weight | 426.09 g/mol |
| LogP | 5.1382 |
| Topological Polar Surface Area | 68.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 426.09174 |
| Heavy Atoms | 29 |
| Complexity | 1062.356 |
Chemical Identifiers
| CAS Number | 354777-40-5 |
|---|---|
| SMILES | CCCSC1=NC2=C(C3=CC=CC=C3N(C(O2)C4=CC(=CC=C4)Cl)C(=O)C)N=N1 |
Product Overview
AN-655/14023030 (CAS 354777-40-5), with molecular formula C21H19ClN4O2S and molecular weight 426.09 g/mol. IUPAC: 1-[6-(3-chlorophenyl)-3-propylsulfanyl-6H-[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7-yl]ethanone.
Chemical Property Profile of AN-655/14023030
Property Insights of AN-655/14023030
The XLogP value of 5.1382 indicates that AN-655/14023030 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 AN-655/14023030. Following Lipinski's Rule of Five, AN-655/14023030 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AN-655/14023030?
The CAS number of AN-655/14023030 is 354777-40-5.
What is the molecular formula of AN-655/14023030?
The molecular formula of AN-655/14023030 is C21H19ClN4O2S.
What is the molecular weight of AN-655/14023030?
The molecular weight of AN-655/14023030 is 426.09 g/mol.
Where can I buy AN-655/14023030?
You can request a quote for AN-655/14023030 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-655/14023030?
Yes, KEHONG BIO provides custom synthesis services for AN-655/14023030 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.