BAS 01292741
TL;DR: BAS 01292741 (CAS 302804-62-2) is a chemical compound with molecular formula C9H7Cl2N3S and molecular weight 258.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2,4-dichlorophenyl)methylsulfanyl]-1H-1,2,4-triazole
Also Known As: BAS 01292741, 5-[(2,4-dichlorobenzyl)thio]-1H-1,2,4-triazole, 5-[(2,4-dichlorophenyl)methylsulfanyl]-1H-1,2,4-triazole, 3-[(2,4-dichlorobenzyl)sulfanyl]-4H-1,2,4-triazole, 5-((2,4-dichlorobenzyl)thio)-1H-1,2,4-triazole
| Molecular Formula | C9H7Cl2N3S |
|---|---|
| Molecular Weight | 258.97 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 66.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.9738 |
| Heavy Atoms | 15 |
| Complexity | 208.0 |
Chemical Identifiers
| CAS Number | 302804-62-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)Cl)CSC2=NC=NN2 |
| InChIKey | WJKLXZUPGLXUDY-UHFFFAOYSA-N |
Product Overview
BAS 01292741 (CAS 302804-62-2), with molecular formula C9H7Cl2N3S and molecular weight 258.97 g/mol. IUPAC: 5-[(2,4-dichlorophenyl)methylsulfanyl]-1H-1,2,4-triazole.
Chemical Property Profile of BAS 01292741
Property Insights of BAS 01292741
The XLogP value of 3.6 indicates that BAS 01292741 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.9 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01292741. Following Lipinski's Rule of Five, BAS 01292741 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 BAS 01292741?
The CAS number of BAS 01292741 is 302804-62-2.
What is the molecular formula of BAS 01292741?
The molecular formula of BAS 01292741 is C9H7Cl2N3S.
What is the molecular weight of BAS 01292741?
The molecular weight of BAS 01292741 is 258.97 g/mol.
Where can I buy BAS 01292741?
You can request a quote for BAS 01292741 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01292741?
Yes, KEHONG BIO provides custom synthesis services for BAS 01292741 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.