Tiotidine
TL;DR: Tiotidine (CAS 69014-14-8) is a chemical compound with molecular formula C10H16N8S2 and molecular weight 312.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyano-3-[2-[[2-(diaminomethylideneamino)-1,3-thiazol-4-yl]methylsulfanyl]ethyl]-2-methylguanidine
Also Known As: TIOTIDINE, Tiotidina, Tiotidinum, [3H]tiotidine, Tipepidine
| Molecular Formula | C10H16N8S2 |
|---|---|
| Molecular Weight | 312.09 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 191.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 312.09393 |
| Heavy Atoms | 20 |
| Complexity | 397.0 |
Chemical Identifiers
| CAS Number | 69014-14-8 |
|---|---|
| SMILES | CN=C(NCCSCC1=CSC(=N1)N=C(N)N)NC#N |
| InChIKey | YDDXVAXDYKBWDX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tiotidine (CAS 69014-14-8), with molecular formula C10H16N8S2 and molecular weight 312.09 g/mol. IUPAC: 1-cyano-3-[2-[[2-(diaminomethylideneamino)-1,3-thiazol-4-yl]methylsulfanyl]ethyl]-2-methylguanidine.
Chemical Property Profile of Tiotidine
Property Insights of Tiotidine
The XLogP value of -0.4 indicates that Tiotidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 191.0 Ų indicates high polarity, suggesting Tiotidine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tiotidine has 4 hydrogen bond donor(s) and 6 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 Tiotidine?
The CAS number of Tiotidine is 69014-14-8.
What is the molecular formula of Tiotidine?
The molecular formula of Tiotidine is C10H16N8S2.
What is the molecular weight of Tiotidine?
The molecular weight of Tiotidine is 312.09 g/mol.
Where can I buy Tiotidine?
You can request a quote for Tiotidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tiotidine?
Yes, KEHONG BIO provides custom synthesis services for Tiotidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.