Subendazole
TL;DR: Subendazole (CAS 6294-85-5) is a chemical compound with molecular formula C10H5Cl3N4S3 and molecular weight 381.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylsulfanyl-5-[(4,6,7-trichloro-1H-benzimidazol-2-yl)sulfanyl]-1,2,4-thiadiazole
Also Known As: Subendazole, Subendazol, Subendazolum, Subendazole [INN:DCF], SUBENDAZOLE [INN]
| Molecular Formula | C10H5Cl3N4S3 |
|---|---|
| Molecular Weight | 381.87 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 133.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 381.8742 |
| Heavy Atoms | 20 |
| Complexity | 356.0 |
Chemical Identifiers
| CAS Number | 6294-85-5 |
|---|---|
| SMILES | CSC1=NSC(=N1)SC2=NC3=C(N2)C(=C(C=C3Cl)Cl)Cl |
| InChIKey | DFNZCGDKDPIQQY-UHFFFAOYSA-N |
Product Overview
Subendazole (CAS 6294-85-5), with molecular formula C10H5Cl3N4S3 and molecular weight 381.87 g/mol. IUPAC: 3-methylsulfanyl-5-[(4,6,7-trichloro-1H-benzimidazol-2-yl)sulfanyl]-1,2,4-thiadiazole.
Chemical Property Profile of Subendazole
Property Insights of Subendazole
The XLogP value of 5.8 indicates that Subendazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Subendazole. Following Lipinski's Rule of Five, Subendazole has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Subendazole?
The CAS number of Subendazole is 6294-85-5.
What is the molecular formula of Subendazole?
The molecular formula of Subendazole is C10H5Cl3N4S3.
What is the molecular weight of Subendazole?
The molecular weight of Subendazole is 381.87 g/mol.
Where can I buy Subendazole?
You can request a quote for Subendazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Subendazole?
Yes, KEHONG BIO provides custom synthesis services for Subendazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.