2-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide
TL;DR: 2-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide (CAS 313375-39-2) is a chemical compound with molecular formula C10H7ClN4O3S and molecular weight 297.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide
Also Known As: 2-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide, AH-034/34344023, 2-chloro-5-nitro-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide, F3097-1748, (2-chloro-5-nitrophenyl)-N-(5-methyl(1,3,4-thiadiazol-2-yl))carboxamide
| Molecular Formula | C10H7ClN4O3S |
|---|---|
| Molecular Weight | 297.99 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 297.99274 |
| Heavy Atoms | 19 |
| Complexity | 367.0 |
Chemical Identifiers
| CAS Number | 313375-39-2 |
|---|---|
| SMILES | CC1=NN=C(S1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl |
| InChIKey | APJJSURYIMGNJQ-UHFFFAOYSA-N |
Product Overview
2-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide (CAS 313375-39-2), with molecular formula C10H7ClN4O3S and molecular weight 297.99 g/mol. IUPAC: 2-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide.
Chemical Property Profile of 2-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide
Property Insights of 2-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide. Following Lipinski's Rule of Five, 2-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide has 1 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 2-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide?
The CAS number of 2-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide is 313375-39-2.
What is the molecular formula of 2-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide?
The molecular formula of 2-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide is C10H7ClN4O3S.
What is the molecular weight of 2-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide?
The molecular weight of 2-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide is 297.99 g/mol.
Where can I buy 2-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide?
You can request a quote for 2-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.