AN-655/13943023
TL;DR: AN-655/13943023 (CAS 354776-74-2) is a chemical compound with molecular formula C17H14BrN5OS and molecular weight 415.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-bromo-3-ethylsulfanyl-6-pyridin-3-yl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Also Known As: AN-655/13943023, 10-bromo-3-ethylsulfanyl-6-pyridin-3-yl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine, 10-bromo-6-(3-pyridinyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-3-yl ethyl sulfide, 10-bromo-3-(ethylsulfanyl)-6-(3-pyridyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
| Molecular Formula | C17H14BrN5OS |
|---|---|
| Molecular Weight | 415.01 g/mol |
| LogP | 4.3112 |
| Topological Polar Surface Area | 72.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 415.01025 |
| Heavy Atoms | 25 |
| Complexity | 908.795 |
Chemical Identifiers
| CAS Number | 354776-74-2 |
|---|---|
| SMILES | CCSC1=NC2=C(C3=C(C=CC(=C3)Br)NC(O2)C4=CN=CC=C4)N=N1 |
Product Overview
AN-655/13943023 (CAS 354776-74-2), with molecular formula C17H14BrN5OS and molecular weight 415.01 g/mol. IUPAC: 10-bromo-3-ethylsulfanyl-6-pyridin-3-yl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine.
Chemical Property Profile of AN-655/13943023
Property Insights of AN-655/13943023
The XLogP value of 4.3112 indicates that AN-655/13943023 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.82 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-655/13943023. Following Lipinski's Rule of Five, AN-655/13943023 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-655/13943023?
The CAS number of AN-655/13943023 is 354776-74-2.
What is the molecular formula of AN-655/13943023?
The molecular formula of AN-655/13943023 is C17H14BrN5OS.
What is the molecular weight of AN-655/13943023?
The molecular weight of AN-655/13943023 is 415.01 g/mol.
Where can I buy AN-655/13943023?
You can request a quote for AN-655/13943023 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-655/13943023?
Yes, KEHONG BIO provides custom synthesis services for AN-655/13943023 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.