N-(1,2,3-Thiadiazol-5-yl)benzamide
TL;DR: N-(1,2,3-Thiadiazol-5-yl)benzamide (CAS 2039-11-4) is a chemical compound with molecular formula C9H7N3OS and molecular weight 205.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(thiadiazol-5-yl)benzamide
Also Known As: N-(1,2,3-Thiadiazol-5-yl)benzamide, N-(thiadiazol-5-yl)benzamide, 5-Benzamido-1,2,3-thiadiazole, N-(1,2,3-Thiadiazole-5-yl)benzamide, J3.430.226J
| Molecular Formula | C9H7N3OS |
|---|---|
| Molecular Weight | 205.03 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 205.03099 |
| Heavy Atoms | 14 |
| Complexity | 206.0 |
Chemical Identifiers
| CAS Number | 2039-11-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC2=CN=NS2 |
| InChIKey | HXZKWLREFWMGEV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(1,2,3-Thiadiazol-5-yl)benzamide (CAS 2039-11-4), with molecular formula C9H7N3OS and molecular weight 205.03 g/mol. IUPAC: N-(thiadiazol-5-yl)benzamide.
Chemical Property Profile of N-(1,2,3-Thiadiazol-5-yl)benzamide
Property Insights of N-(1,2,3-Thiadiazol-5-yl)benzamide
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,2,3-Thiadiazol-5-yl)benzamide. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,2,3-Thiadiazol-5-yl)benzamide. Following Lipinski's Rule of Five, N-(1,2,3-Thiadiazol-5-yl)benzamide has 1 hydrogen bond donor(s) and 4 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 N-(1,2,3-Thiadiazol-5-yl)benzamide?
The CAS number of N-(1,2,3-Thiadiazol-5-yl)benzamide is 2039-11-4.
What is the molecular formula of N-(1,2,3-Thiadiazol-5-yl)benzamide?
The molecular formula of N-(1,2,3-Thiadiazol-5-yl)benzamide is C9H7N3OS.
What is the molecular weight of N-(1,2,3-Thiadiazol-5-yl)benzamide?
The molecular weight of N-(1,2,3-Thiadiazol-5-yl)benzamide is 205.03 g/mol.
Where can I buy N-(1,2,3-Thiadiazol-5-yl)benzamide?
You can request a quote for N-(1,2,3-Thiadiazol-5-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,2,3-Thiadiazol-5-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,2,3-Thiadiazol-5-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.