AN-655/13869019
TL;DR: AN-655/13869019 (CAS 353519-95-6) is a chemical compound with molecular formula C19H17BrN4O2S and molecular weight 444.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-bromo-3-ethylsulfanyl-6-(2-methoxyphenyl)-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Also Known As: AN-655/13869019, 10-bromo-3-ethylsulfanyl-6-(2-methoxyphenyl)-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine, 10-BROMO-3-(ETHYLSULFANYL)-6-(2-METHOXYPHENYL)-6,7-DIHYDRO[1,2,4]TRIAZINO[5,6-D][3,1]BENZOXAZEPINE, 10-bromo-3-(ethylthio)-6-(2-methoxyphenyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine, 2-[10-bromo-3-(ethylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl]phenyl methyl ether
| Molecular Formula | C19H17BrN4O2S |
|---|---|
| Molecular Weight | 444.03 g/mol |
| LogP | 4.9248 |
| Topological Polar Surface Area | 69.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 444.02557 |
| Heavy Atoms | 27 |
| Complexity | 985.6735 |
Chemical Identifiers
| CAS Number | 353519-95-6 |
|---|---|
| SMILES | CCSC1=NC2=C(C3=C(C=CC(=C3)Br)NC(O2)C4=CC=CC=C4OC)N=N1 |
Product Overview
AN-655/13869019 (CAS 353519-95-6), with molecular formula C19H17BrN4O2S and molecular weight 444.03 g/mol. IUPAC: 10-bromo-3-ethylsulfanyl-6-(2-methoxyphenyl)-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine.
Chemical Property Profile of AN-655/13869019
Property Insights of AN-655/13869019
The XLogP value of 4.9248 indicates that AN-655/13869019 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-655/13869019. Following Lipinski's Rule of Five, AN-655/13869019 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-655/13869019?
The CAS number of AN-655/13869019 is 353519-95-6.
What is the molecular formula of AN-655/13869019?
The molecular formula of AN-655/13869019 is C19H17BrN4O2S.
What is the molecular weight of AN-655/13869019?
The molecular weight of AN-655/13869019 is 444.03 g/mol.
Where can I buy AN-655/13869019?
You can request a quote for AN-655/13869019 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-655/13869019?
Yes, KEHONG BIO provides custom synthesis services for AN-655/13869019 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.