AN-655/14219003
TL;DR: AN-655/14219003 (CAS 426252-69-9) is a chemical compound with molecular formula C25H22N6O3S and molecular weight 486.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(7-acetyl-3-ethylsulfanyl-6H-[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl)-3-phenylpyrazol-1-yl]ethanone
Also Known As: AN-655/14219003, 1-[4-(7-acetyl-3-ethylsulfanyl-6H-[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl)-3-phenylpyrazol-1-yl]ethanone, 7-acetyl-6-(1-acetyl-3-phenyl-1H-pyrazol-4-yl)-3-(ethylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine, 1-{4-[7-acetyl-3-(ethylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl]-3-phenyl-1H-pyrazol-1-yl}ethanone, 1-{4-[7-ACETYL-3-(ETHYLSULFANYL)[1,2,4]TRIAZINO[5,6-D][3,1]BENZOXAZEPIN-6(6H)-YL]-3-PHENYL-1H-PYRAZOL-1-YL}-1-ETHANONE
| Molecular Formula | C25H22N6O3S |
|---|---|
| Molecular Weight | 486.15 g/mol |
| LogP | 4.6183 |
| Topological Polar Surface Area | 103.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 486.1474 |
| Heavy Atoms | 35 |
| Complexity | 1421.9867 |
Chemical Identifiers
| CAS Number | 426252-69-9 |
|---|---|
| SMILES | CCSC1=NC2=C(C3=CC=CC=C3N(C(O2)C4=CN(N=C4C5=CC=CC=C5)C(=O)C)C(=O)C)N=N1 |
Product Overview
AN-655/14219003 (CAS 426252-69-9), with molecular formula C25H22N6O3S and molecular weight 486.15 g/mol. IUPAC: 1-[4-(7-acetyl-3-ethylsulfanyl-6H-[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl)-3-phenylpyrazol-1-yl]ethanone.
Chemical Property Profile of AN-655/14219003
Property Insights of AN-655/14219003
The XLogP value of 4.6183 indicates that AN-655/14219003 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.1 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-655/14219003. Following Lipinski's Rule of Five, AN-655/14219003 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 AN-655/14219003?
The CAS number of AN-655/14219003 is 426252-69-9.
What is the molecular formula of AN-655/14219003?
The molecular formula of AN-655/14219003 is C25H22N6O3S.
What is the molecular weight of AN-655/14219003?
The molecular weight of AN-655/14219003 is 486.15 g/mol.
Where can I buy AN-655/14219003?
You can request a quote for AN-655/14219003 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-655/14219003?
Yes, KEHONG BIO provides custom synthesis services for AN-655/14219003 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.