2-chloro-4-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide
TL;DR: 2-chloro-4-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide (CAS 313223-08-4) is a chemical compound with molecular formula C9H5ClN4O3S and molecular weight 283.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-4-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide
Also Known As: 2-chloro-4-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide, AH-034/33496039, 2-chloro-4-nitro-N-(1,3,4-thiadiazol-2-yl)benz-amide, (2-chloro-4-nitrophenyl)-N-(1,3,4-thiadiazol-2-yl)carboxamide
| Molecular Formula | C9H5ClN4O3S |
|---|---|
| Molecular Weight | 283.98 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 283.97708 |
| Heavy Atoms | 18 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 313223-08-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])Cl)C(=O)NC2=NN=CS2 |
| InChIKey | LMWGYJAKKMDORM-UHFFFAOYSA-N |
Product Overview
2-chloro-4-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide (CAS 313223-08-4), with molecular formula C9H5ClN4O3S and molecular weight 283.98 g/mol. IUPAC: 2-chloro-4-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide.
Chemical Property Profile of 2-chloro-4-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide
Property Insights of 2-chloro-4-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-4-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-4-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide. Following Lipinski's Rule of Five, 2-chloro-4-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide 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-4-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide?
The CAS number of 2-chloro-4-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide is 313223-08-4.
What is the molecular formula of 2-chloro-4-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide?
The molecular formula of 2-chloro-4-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide is C9H5ClN4O3S.
What is the molecular weight of 2-chloro-4-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide?
The molecular weight of 2-chloro-4-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide is 283.98 g/mol.
Where can I buy 2-chloro-4-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide?
You can request a quote for 2-chloro-4-nitro-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 2-chloro-4-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-4-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.