AB00686523-01
TL;DR: AB00686523-01 (CAS 868222-01-9) is a chemical compound with molecular formula C19H23N5S2 and molecular weight 385.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-ethylsulfanyl-4-(2-phenylethyl)-1,2,4-triazol-3-yl]methylsulfanyl]-4,6-dimethylpyrimidine
Also Known As: AB00686523-01, F1806-0119, 2-({[5-(ethylsulfanyl)-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]methyl}sulfanyl)-4,6-dimethylpyrimidine, 2-(((5-(ethylthio)-4-phenethyl-4H-1,2,4-triazol-3-yl)methyl)thio)-4,6-dimethylpyrimidine, 2-[(5-ethylsulfanyl-4-phenethyl-1,2,4-triazol-3-yl)methylsulfanyl]-4,6-dimethylpyrimidine
| Molecular Formula | C19H23N5S2 |
|---|---|
| Molecular Weight | 385.14 g/mol |
| LogP | 4.33194 |
| Topological Polar Surface Area | 56.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 385.1395 |
| Heavy Atoms | 26 |
| Complexity | 828.14075 |
Chemical Identifiers
| CAS Number | 868222-01-9 |
|---|---|
| SMILES | CCSC1=NN=C(N1CCC2=CC=CC=C2)CSC3=NC(=CC(=N3)C)C |
Product Overview
AB00686523-01 (CAS 868222-01-9), with molecular formula C19H23N5S2 and molecular weight 385.14 g/mol. IUPAC: 2-[[5-ethylsulfanyl-4-(2-phenylethyl)-1,2,4-triazol-3-yl]methylsulfanyl]-4,6-dimethylpyrimidine.
Chemical Property Profile of AB00686523-01
Property Insights of AB00686523-01
The XLogP value of 4.33194 indicates that AB00686523-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.49 Ų, AB00686523-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00686523-01 has 0 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 AB00686523-01?
The CAS number of AB00686523-01 is 868222-01-9.
What is the molecular formula of AB00686523-01?
The molecular formula of AB00686523-01 is C19H23N5S2.
What is the molecular weight of AB00686523-01?
The molecular weight of AB00686523-01 is 385.14 g/mol.
Where can I buy AB00686523-01?
You can request a quote for AB00686523-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00686523-01?
Yes, KEHONG BIO provides custom synthesis services for AB00686523-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.