3,4-dimethyl-N-(1,3,4-thiadiazol-2-yl)benzamide
TL;DR: 3,4-dimethyl-N-(1,3,4-thiadiazol-2-yl)benzamide (CAS 313534-60-0) is a chemical compound with molecular formula C11H11N3OS and molecular weight 233.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dimethyl-N-(1,3,4-thiadiazol-2-yl)benzamide
Also Known As: 3,4-dimethyl-N-(1,3,4-thiadiazol-2-yl)benzamide, BAS 03033032, 3,4-dimethyl-N-1,3,4-thiadiazol-2-ylbenzamide, 3,4-Dimethyl-N-[1,3,4]thiadiazol-2-yl-benzamide, (3,4-dimethylphenyl)-N-(1,3,4-thiadiazol-2-yl)carboxamide
| Molecular Formula | C11H11N3OS |
|---|---|
| Molecular Weight | 233.06 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 233.06229 |
| Heavy Atoms | 16 |
| Complexity | 262.0 |
Chemical Identifiers
| CAS Number | 313534-60-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NC2=NN=CS2)C |
| InChIKey | HYDBLSBZRQBXGZ-UHFFFAOYSA-N |
Product Overview
3,4-dimethyl-N-(1,3,4-thiadiazol-2-yl)benzamide (CAS 313534-60-0), with molecular formula C11H11N3OS and molecular weight 233.06 g/mol. IUPAC: 3,4-dimethyl-N-(1,3,4-thiadiazol-2-yl)benzamide.
Chemical Property Profile of 3,4-dimethyl-N-(1,3,4-thiadiazol-2-yl)benzamide
Property Insights of 3,4-dimethyl-N-(1,3,4-thiadiazol-2-yl)benzamide
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-dimethyl-N-(1,3,4-thiadiazol-2-yl)benzamide. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-dimethyl-N-(1,3,4-thiadiazol-2-yl)benzamide. Following Lipinski's Rule of Five, 3,4-dimethyl-N-(1,3,4-thiadiazol-2-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 3,4-dimethyl-N-(1,3,4-thiadiazol-2-yl)benzamide?
The CAS number of 3,4-dimethyl-N-(1,3,4-thiadiazol-2-yl)benzamide is 313534-60-0.
What is the molecular formula of 3,4-dimethyl-N-(1,3,4-thiadiazol-2-yl)benzamide?
The molecular formula of 3,4-dimethyl-N-(1,3,4-thiadiazol-2-yl)benzamide is C11H11N3OS.
What is the molecular weight of 3,4-dimethyl-N-(1,3,4-thiadiazol-2-yl)benzamide?
The molecular weight of 3,4-dimethyl-N-(1,3,4-thiadiazol-2-yl)benzamide is 233.06 g/mol.
Where can I buy 3,4-dimethyl-N-(1,3,4-thiadiazol-2-yl)benzamide?
You can request a quote for 3,4-dimethyl-N-(1,3,4-thiadiazol-2-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-dimethyl-N-(1,3,4-thiadiazol-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3,4-dimethyl-N-(1,3,4-thiadiazol-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.