BB 0217509
TL;DR: BB 0217509 (CAS 792941-77-6) is a chemical compound with molecular formula C15H19N3OS and molecular weight 289.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethyl-3-(5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)-1H-1,2,4-triazole-5-thione
Also Known As: BB 0217509, 4-Ethyl-5-(5,6,7,8-tetrahydro-naphthalen-2-yloxymethyl)-4H-[1,2,4]triazole-3-thiol, 4-ethyl-5-[(5,6,7,8-tetrahydronaphthalen-2-yloxy)methyl]-4H-1,2,4-triazole-3-thiol, 4-ethyl-3-(5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)-1H-1,2,4-triazole-5-thione, 4-Ethyl-5-(5,6,7,8-tetrahydro-naphthalen-2-yl oxymethyl)-4H-[1,2,4]triazole-3-thiol
| Molecular Formula | C15H19N3OS |
|---|---|
| Molecular Weight | 289.12 g/mol |
| LogP | 3.41839 |
| Topological Polar Surface Area | 42.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.12488 |
| Heavy Atoms | 20 |
| Complexity | 659.3785 |
Chemical Identifiers
| CAS Number | 792941-77-6 |
|---|---|
| SMILES | CCN1C(=NNC1=S)COC2=CC3=C(CCCC3)C=C2 |
Product Overview
BB 0217509 (CAS 792941-77-6), with molecular formula C15H19N3OS and molecular weight 289.12 g/mol. IUPAC: 4-ethyl-3-(5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of BB 0217509
Property Insights of BB 0217509
The XLogP value of 3.41839 indicates that BB 0217509 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.84 Ų, BB 0217509 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BB 0217509 has 1 hydrogen bond donor(s) and 3 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 BB 0217509?
The CAS number of BB 0217509 is 792941-77-6.
What is the molecular formula of BB 0217509?
The molecular formula of BB 0217509 is C15H19N3OS.
What is the molecular weight of BB 0217509?
The molecular weight of BB 0217509 is 289.12 g/mol.
Where can I buy BB 0217509?
You can request a quote for BB 0217509 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BB 0217509?
Yes, KEHONG BIO provides custom synthesis services for BB 0217509 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.