AN-655/14058006
TL;DR: AN-655/14058006 (CAS 428481-25-8) is a chemical compound with molecular formula C16H17BrN4OS and molecular weight 392.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-bromo-3-ethylsulfanylspiro[7H-[1,2,4]triazino[5,6-d][3,1]benzoxazepine-6,1'-cyclopentane]
Also Known As: AN-655/14058006, 10-bromo-3-ethylsulfanylspiro[7H-[1,2,4]triazino[5,6-d][3,1]benzoxazepine-6,1'-cyclopentane], 10-bromo-3-(ethylthio)-6,7-dihydrospiro([1,2,4]triazino[5,6-d][3,1]benzoxazepine-6,1'-cyclopentane), 10'-bromo-3'-(ethylthio)-7'H-spiro[cyclopentane-1,6'-[1,2,4]triazino[5,6-d][3,1]benzoxazepine]
| Molecular Formula | C16H17BrN4OS |
|---|---|
| Molecular Weight | 392.03 g/mol |
| LogP | 4.4877 |
| Topological Polar Surface Area | 59.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 392.03064 |
| Heavy Atoms | 23 |
| Complexity | 748.8552 |
Chemical Identifiers
| CAS Number | 428481-25-8 |
|---|---|
| SMILES | CCSC1=NC2=C(C3=C(C=CC(=C3)Br)NC4(O2)CCCC4)N=N1 |
Product Overview
AN-655/14058006 (CAS 428481-25-8), with molecular formula C16H17BrN4OS and molecular weight 392.03 g/mol. IUPAC: 10-bromo-3-ethylsulfanylspiro[7H-[1,2,4]triazino[5,6-d][3,1]benzoxazepine-6,1'-cyclopentane].
Chemical Property Profile of AN-655/14058006
Property Insights of AN-655/14058006
The XLogP value of 4.4877 indicates that AN-655/14058006 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-655/14058006 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-655/14058006 has 1 hydrogen bond donor(s) and 6 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-655/14058006?
The CAS number of AN-655/14058006 is 428481-25-8.
What is the molecular formula of AN-655/14058006?
The molecular formula of AN-655/14058006 is C16H17BrN4OS.
What is the molecular weight of AN-655/14058006?
The molecular weight of AN-655/14058006 is 392.03 g/mol.
Where can I buy AN-655/14058006?
You can request a quote for AN-655/14058006 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-655/14058006?
Yes, KEHONG BIO provides custom synthesis services for AN-655/14058006 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.