5-(Phenoxymethyl)-1,2,3-thiadiazole-4-carboxamide
TL;DR: 5-(Phenoxymethyl)-1,2,3-thiadiazole-4-carboxamide (CAS 4609-52-3) is a chemical compound with molecular formula C10H9N3O2S and molecular weight 235.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(phenoxymethyl)thiadiazole-4-carboxamide
Also Known As: 5-(phenoxymethyl)thiadiazole-4-carboxamide, 5-(phenoxymethyl)-1,2,3-thiadiazole-4-carboxamide, 1,2,3-Thiadiazole-4-carboxamide,5-(phenoxymethyl)-, 4-Carbamoyl-5-phenoxymethyl-1.2.3-thiadiazol
| Molecular Formula | C10H9N3O2S |
|---|---|
| Molecular Weight | 235.04 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 235.04155 |
| Heavy Atoms | 16 |
| Complexity | 246.0 |
Chemical Identifiers
| CAS Number | 4609-52-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)OCC2=C(N=NS2)C(=O)N |
| InChIKey | POGFSAPGXOCUFZ-UHFFFAOYSA-N |
Product Overview
5-(Phenoxymethyl)-1,2,3-thiadiazole-4-carboxamide (CAS 4609-52-3), with molecular formula C10H9N3O2S and molecular weight 235.04 g/mol. IUPAC: 5-(phenoxymethyl)thiadiazole-4-carboxamide.
Chemical Property Profile of 5-(Phenoxymethyl)-1,2,3-thiadiazole-4-carboxamide
Property Insights of 5-(Phenoxymethyl)-1,2,3-thiadiazole-4-carboxamide
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Phenoxymethyl)-1,2,3-thiadiazole-4-carboxamide. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(Phenoxymethyl)-1,2,3-thiadiazole-4-carboxamide. Following Lipinski's Rule of Five, 5-(Phenoxymethyl)-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-(Phenoxymethyl)-1,2,3-thiadiazole-4-carboxamide?
The CAS number of 5-(Phenoxymethyl)-1,2,3-thiadiazole-4-carboxamide is 4609-52-3.
What is the molecular formula of 5-(Phenoxymethyl)-1,2,3-thiadiazole-4-carboxamide?
The molecular formula of 5-(Phenoxymethyl)-1,2,3-thiadiazole-4-carboxamide is C10H9N3O2S.
What is the molecular weight of 5-(Phenoxymethyl)-1,2,3-thiadiazole-4-carboxamide?
The molecular weight of 5-(Phenoxymethyl)-1,2,3-thiadiazole-4-carboxamide is 235.04 g/mol.
Where can I buy 5-(Phenoxymethyl)-1,2,3-thiadiazole-4-carboxamide?
You can request a quote for 5-(Phenoxymethyl)-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-(Phenoxymethyl)-1,2,3-thiadiazole-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-(Phenoxymethyl)-1,2,3-thiadiazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.