5-(Methylthio)-N-phenyl-1,2,3-thiadiazole-4-carboxamide
TL;DR: 5-(Methylthio)-N-phenyl-1,2,3-thiadiazole-4-carboxamide (CAS 677720-53-5) is a chemical compound with molecular formula C10H9N3OS2 and molecular weight 251.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methylsulfanyl-N-phenylthiadiazole-4-carboxamide
Also Known As: 5-methylsulfanyl-N-phenylthiadiazole-4-carboxamide, 5-(Methylthio)-N-phenyl-1,2,3-thiadiazole-4-carboxamide, 5-methylsulfanyl-N-phenyl-thiadiazole-4-carboxamide, 1,2,3-thiadiazole-4-carboxamide,5-(methylthio)-n-phenyl-, 5-(methylsulfanyl)-N-phenyl-1,2,3-thiadiazole-4-carboxamide
| Molecular Formula | C10H9N3OS2 |
|---|---|
| Molecular Weight | 251.02 g/mol |
| LogP | 2.5123 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.0187 |
| Heavy Atoms | 16 |
| Complexity | 483.81918 |
Chemical Identifiers
| CAS Number | 677720-53-5 |
|---|---|
| SMILES | CSC1=C(N=NS1)C(=O)NC2=CC=CC=C2 |
Product Overview
5-(Methylthio)-N-phenyl-1,2,3-thiadiazole-4-carboxamide (CAS 677720-53-5), with molecular formula C10H9N3OS2 and molecular weight 251.02 g/mol. IUPAC: 5-methylsulfanyl-N-phenylthiadiazole-4-carboxamide.
Chemical Property Profile of 5-(Methylthio)-N-phenyl-1,2,3-thiadiazole-4-carboxamide
Property Insights of 5-(Methylthio)-N-phenyl-1,2,3-thiadiazole-4-carboxamide
The XLogP value of 2.5123 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Methylthio)-N-phenyl-1,2,3-thiadiazole-4-carboxamide. With a topological polar surface area (TPSA) of 54.88 Ų, 5-(Methylthio)-N-phenyl-1,2,3-thiadiazole-4-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Methylthio)-N-phenyl-1,2,3-thiadiazole-4-carboxamide 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 5-(Methylthio)-N-phenyl-1,2,3-thiadiazole-4-carboxamide?
The CAS number of 5-(Methylthio)-N-phenyl-1,2,3-thiadiazole-4-carboxamide is 677720-53-5.
What is the molecular formula of 5-(Methylthio)-N-phenyl-1,2,3-thiadiazole-4-carboxamide?
The molecular formula of 5-(Methylthio)-N-phenyl-1,2,3-thiadiazole-4-carboxamide is C10H9N3OS2.
What is the molecular weight of 5-(Methylthio)-N-phenyl-1,2,3-thiadiazole-4-carboxamide?
The molecular weight of 5-(Methylthio)-N-phenyl-1,2,3-thiadiazole-4-carboxamide is 251.02 g/mol.
Where can I buy 5-(Methylthio)-N-phenyl-1,2,3-thiadiazole-4-carboxamide?
You can request a quote for 5-(Methylthio)-N-phenyl-1,2,3-thiadiazole-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Methylthio)-N-phenyl-1,2,3-thiadiazole-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-(Methylthio)-N-phenyl-1,2,3-thiadiazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.