AN-655/13943049
TL;DR: AN-655/13943049 (CAS 354777-03-0) is a chemical compound with molecular formula C23H16Cl2N4OS and molecular weight 466.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2-chlorophenyl)-3-[(2-chlorophenyl)methylsulfanyl]-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Also Known As: AN-655/13943049, 6-(2-chlorophenyl)-3-[(2-chlorophenyl)methylsulfanyl]-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine, 2-chlorobenzyl 6-(2-chlorophenyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-3-yl sulfide
| Molecular Formula | C23H16Cl2N4OS |
|---|---|
| Molecular Weight | 466.04 g/mol |
| LogP | 6.6408 |
| Topological Polar Surface Area | 59.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 466.04218 |
| Heavy Atoms | 31 |
| Complexity | 1253.6866 |
Chemical Identifiers
| CAS Number | 354777-03-0 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CSC2=NC3=C(C4=CC=CC=C4NC(O3)C5=CC=CC=C5Cl)N=N2)Cl |
Product Overview
AN-655/13943049 (CAS 354777-03-0), with molecular formula C23H16Cl2N4OS and molecular weight 466.04 g/mol. IUPAC: 6-(2-chlorophenyl)-3-[(2-chlorophenyl)methylsulfanyl]-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine.
Chemical Property Profile of AN-655/13943049
Property Insights of AN-655/13943049
The XLogP value of 6.6408 indicates that AN-655/13943049 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.93 Ų, AN-655/13943049 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-655/13943049 has 1 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-655/13943049?
The CAS number of AN-655/13943049 is 354777-03-0.
What is the molecular formula of AN-655/13943049?
The molecular formula of AN-655/13943049 is C23H16Cl2N4OS.
What is the molecular weight of AN-655/13943049?
The molecular weight of AN-655/13943049 is 466.04 g/mol.
Where can I buy AN-655/13943049?
You can request a quote for AN-655/13943049 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-655/13943049?
Yes, KEHONG BIO provides custom synthesis services for AN-655/13943049 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.