C15H7Cl3N4S
TL;DR: C15H7Cl3N4S (CAS 585559-12-2) is a chemical compound with molecular formula C15H7Cl3N4S and molecular weight 379.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-chlorophenyl)-6-(2,4-dichlorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: 3-(3-chlorophenyl)-6-(2,4-dichlorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 3-(3-chlorophenyl)-6-(2,4-dichlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
| Molecular Formula | C15H7Cl3N4S |
|---|---|
| Molecular Weight | 379.95 g/mol |
| LogP | 5.48 |
| Topological Polar Surface Area | 43.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 379.9457 |
| Heavy Atoms | 23 |
| Complexity | 1024.6693 |
Chemical Identifiers
| CAS Number | 585559-12-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)C2=NN=C3N2N=C(S3)C4=C(C=C(C=C4)Cl)Cl |
Product Overview
C15H7Cl3N4S (CAS 585559-12-2), with molecular formula C15H7Cl3N4S and molecular weight 379.95 g/mol. IUPAC: 3-(3-chlorophenyl)-6-(2,4-dichlorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of C15H7Cl3N4S
Property Insights of C15H7Cl3N4S
The XLogP value of 5.48 indicates that C15H7Cl3N4S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.08 Ų, C15H7Cl3N4S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C15H7Cl3N4S has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C15H7Cl3N4S?
The CAS number of C15H7Cl3N4S is 585559-12-2.
What is the molecular formula of C15H7Cl3N4S?
The molecular formula of C15H7Cl3N4S is C15H7Cl3N4S.
What is the molecular weight of C15H7Cl3N4S?
The molecular weight of C15H7Cl3N4S is 379.95 g/mol.
Where can I buy C15H7Cl3N4S?
You can request a quote for C15H7Cl3N4S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C15H7Cl3N4S?
Yes, KEHONG BIO provides custom synthesis services for C15H7Cl3N4S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.