AN-655/14573003
TL;DR: AN-655/14573003 (CAS 354780-60-2) is a chemical compound with molecular formula C21H22N4O3S and molecular weight 410.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-butylsulfanyl-6-(5-methylfuran-2-yl)-6H-[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7-yl]ethanone
Also Known As: AN-655/14573003, 1-[3-butylsulfanyl-6-(5-methylfuran-2-yl)-6H-[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7-yl]ethanone, 1-[3-(butylsulfanyl)-6-(5-methylfuran-2-yl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethanone, 1-[3-(BUTYLSULFANYL)-6-(5-METHYL-2-FURYL)[1,2,4]TRIAZINO[5,6-D][3,1]BENZOXAZEPIN-7(6H)-YL]-1-ETHANONE, 7-acetyl-6-(5-methyl-2-furyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-3-yl butyl sulfide
| Molecular Formula | C21H22N4O3S |
|---|---|
| Molecular Weight | 410.14 g/mol |
| LogP | 4.77632 |
| Topological Polar Surface Area | 81.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 410.14127 |
| Heavy Atoms | 29 |
| Complexity | 1036.2706 |
Chemical Identifiers
| CAS Number | 354780-60-2 |
|---|---|
| SMILES | CCCCSC1=NC2=C(C3=CC=CC=C3N(C(O2)C4=CC=C(O4)C)C(=O)C)N=N1 |
Product Overview
AN-655/14573003 (CAS 354780-60-2), with molecular formula C21H22N4O3S and molecular weight 410.14 g/mol. IUPAC: 1-[3-butylsulfanyl-6-(5-methylfuran-2-yl)-6H-[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7-yl]ethanone.
Chemical Property Profile of AN-655/14573003
Property Insights of AN-655/14573003
The XLogP value of 4.77632 indicates that AN-655/14573003 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.35 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-655/14573003. Following Lipinski's Rule of Five, AN-655/14573003 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 AN-655/14573003?
The CAS number of AN-655/14573003 is 354780-60-2.
What is the molecular formula of AN-655/14573003?
The molecular formula of AN-655/14573003 is C21H22N4O3S.
What is the molecular weight of AN-655/14573003?
The molecular weight of AN-655/14573003 is 410.14 g/mol.
Where can I buy AN-655/14573003?
You can request a quote for AN-655/14573003 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-655/14573003?
Yes, KEHONG BIO provides custom synthesis services for AN-655/14573003 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.