Ceefourin 1
TL;DR: Ceefourin 1 (CAS 315702-40-0) is a chemical compound with molecular formula C11H10N4S3 and molecular weight 294.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methyl-1H-1,2,4-triazole-5-thione
Also Known As: Ceefourin 1, 5-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-methyl-4H-1,2,4-triazole-3-thiol, SDCCGMLS-0065042.P001, SDCCGSBI-0660530.P001, 3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methyl-1H-1,2,4-triazole-5-thione
| Molecular Formula | C11H10N4S3 |
|---|---|
| Molecular Weight | 294.01 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 294.00677 |
| Heavy Atoms | 18 |
| Complexity | 373.0 |
Chemical Identifiers
| CAS Number | 315702-40-0 |
|---|---|
| SMILES | CN1C(=NNC1=S)CSC2=NC3=CC=CC=C3S2 |
| InChIKey | KVNBVHCJAUXKPJ-UHFFFAOYSA-N |
Product Overview
Ceefourin 1 (CAS 315702-40-0), with molecular formula C11H10N4S3 and molecular weight 294.01 g/mol. IUPAC: 3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methyl-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of Ceefourin 1
Property Insights of Ceefourin 1
The XLogP value of 3.0 indicates that Ceefourin 1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ceefourin 1. Following Lipinski's Rule of Five, Ceefourin 1 has 1 hydrogen bond donor(s) and 5 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 Ceefourin 1?
The CAS number of Ceefourin 1 is 315702-40-0.
What is the molecular formula of Ceefourin 1?
The molecular formula of Ceefourin 1 is C11H10N4S3.
What is the molecular weight of Ceefourin 1?
The molecular weight of Ceefourin 1 is 294.01 g/mol.
Where can I buy Ceefourin 1?
You can request a quote for Ceefourin 1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ceefourin 1?
Yes, KEHONG BIO provides custom synthesis services for Ceefourin 1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.