AN-655/14023008
TL;DR: AN-655/14023008 (CAS 354777-14-3) is a chemical compound with molecular formula C20H18N4O2S and molecular weight 378.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylsulfanyl-6-(3-prop-2-enoxyphenyl)-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Also Known As: AN-655/14023008, 6-[3-(allyloxy)phenyl]-3-(methylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine, 3-methylsulfanyl-6-(3-prop-2-enoxyphenyl)-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine
| Molecular Formula | C20H18N4O2S |
|---|---|
| Molecular Weight | 378.12 g/mol |
| LogP | 4.3284 |
| Topological Polar Surface Area | 69.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 378.11505 |
| Heavy Atoms | 27 |
| Complexity | 979.70044 |
Chemical Identifiers
| CAS Number | 354777-14-3 |
|---|---|
| SMILES | CSC1=NC2=C(C3=CC=CC=C3NC(O2)C4=CC(=CC=C4)OCC=C)N=N1 |
Product Overview
AN-655/14023008 (CAS 354777-14-3), with molecular formula C20H18N4O2S and molecular weight 378.12 g/mol. IUPAC: 3-methylsulfanyl-6-(3-prop-2-enoxyphenyl)-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine.
Chemical Property Profile of AN-655/14023008
Property Insights of AN-655/14023008
The XLogP value of 4.3284 indicates that AN-655/14023008 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.16 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-655/14023008. Following Lipinski's Rule of Five, AN-655/14023008 has 1 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-655/14023008?
The CAS number of AN-655/14023008 is 354777-14-3.
What is the molecular formula of AN-655/14023008?
The molecular formula of AN-655/14023008 is C20H18N4O2S.
What is the molecular weight of AN-655/14023008?
The molecular weight of AN-655/14023008 is 378.12 g/mol.
Where can I buy AN-655/14023008?
You can request a quote for AN-655/14023008 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-655/14023008?
Yes, KEHONG BIO provides custom synthesis services for AN-655/14023008 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.