4-methoxy-3-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide
TL;DR: 4-methoxy-3-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide (CAS 313498-90-7) is a chemical compound with molecular formula C10H8N4O4S and molecular weight 280.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-3-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide
Also Known As: 4-methoxy-3-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide, AH-034/08461061, 3-nitro-4-methoxy-N-(1,3,4-thiadiazol-2-yl)benzamide, (4-methoxy-3-nitrophenyl)-N-(1,3,4-thiadiazol-2-yl)carboxamide
| Molecular Formula | C10H8N4O4S |
|---|---|
| Molecular Weight | 280.03 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 138.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.0266 |
| Heavy Atoms | 19 |
| Complexity | 351.0 |
Chemical Identifiers
| CAS Number | 313498-90-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)NC2=NN=CS2)[N+](=O)[O-] |
| InChIKey | GXRSMAVCRJSTKK-UHFFFAOYSA-N |
Product Overview
4-methoxy-3-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide (CAS 313498-90-7), with molecular formula C10H8N4O4S and molecular weight 280.03 g/mol. IUPAC: 4-methoxy-3-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide.
Chemical Property Profile of 4-methoxy-3-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide
Property Insights of 4-methoxy-3-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-methoxy-3-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methoxy-3-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide. Following Lipinski's Rule of Five, 4-methoxy-3-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide has 1 hydrogen bond donor(s) and 7 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 4-methoxy-3-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide?
The CAS number of 4-methoxy-3-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide is 313498-90-7.
What is the molecular formula of 4-methoxy-3-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide?
The molecular formula of 4-methoxy-3-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide is C10H8N4O4S.
What is the molecular weight of 4-methoxy-3-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide?
The molecular weight of 4-methoxy-3-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide is 280.03 g/mol.
Where can I buy 4-methoxy-3-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide?
You can request a quote for 4-methoxy-3-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 4-methoxy-3-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-methoxy-3-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.