AN-655/13402038
TL;DR: AN-655/13402038 (CAS 353518-33-9) is a chemical compound with molecular formula C19H14Cl2N4OS and molecular weight 416.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2,6-dichlorophenyl)-3-prop-2-enylsulfanyl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Also Known As: AN-655/13402038, 6-(2,6-dichlorophenyl)-3-prop-2-enylsulfanyl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine, 3-(allylsulfanyl)-6-(2,6-dichlorophenyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
| Molecular Formula | C19H14Cl2N4OS |
|---|---|
| Molecular Weight | 416.03 g/mol |
| LogP | 5.6266 |
| Topological Polar Surface Area | 59.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 416.02655 |
| Heavy Atoms | 27 |
| Complexity | 994.4999 |
Chemical Identifiers
| CAS Number | 353518-33-9 |
|---|---|
| SMILES | C=CCSC1=NC2=C(C3=CC=CC=C3NC(O2)C4=C(C=CC=C4Cl)Cl)N=N1 |
Product Overview
AN-655/13402038 (CAS 353518-33-9), with molecular formula C19H14Cl2N4OS and molecular weight 416.03 g/mol. IUPAC: 6-(2,6-dichlorophenyl)-3-prop-2-enylsulfanyl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine.
Chemical Property Profile of AN-655/13402038
Property Insights of AN-655/13402038
The XLogP value of 5.6266 indicates that AN-655/13402038 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-655/13402038 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-655/13402038 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-655/13402038?
The CAS number of AN-655/13402038 is 353518-33-9.
What is the molecular formula of AN-655/13402038?
The molecular formula of AN-655/13402038 is C19H14Cl2N4OS.
What is the molecular weight of AN-655/13402038?
The molecular weight of AN-655/13402038 is 416.03 g/mol.
Where can I buy AN-655/13402038?
You can request a quote for AN-655/13402038 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-655/13402038?
Yes, KEHONG BIO provides custom synthesis services for AN-655/13402038 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.