![4-ethoxy-N-[(6-methylpyridin-2-yl)carbamothioyl]-3-nitrobenzamide structure](/static/products/4284/428480-98-2.webp)
4-ethoxy-N-[(6-methylpyridin-2-yl)carbamothioyl]-3-nitrobenzamide
TL;DR: 4-ethoxy-N-[(6-methylpyridin-2-yl)carbamothioyl]-3-nitrobenzamide (CAS 428480-98-2) is a chemical compound with molecular formula C16H16N4O4S and molecular weight 360.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethoxy-N-[(6-methyl-2-pyridinyl)carbamothioyl]-3-nitrobenzamide
Also Known As: 4-ethoxy-N-[(6-methylpyridin-2-yl)carbamothioyl]-3-nitrobenzamide, AB00108574-01
| Molecular Formula | C16H16N4O4S |
|---|---|
| Molecular Weight | 360.09 g/mol |
| LogP | 2.82372 |
| Topological Polar Surface Area | 106.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 360.08923 |
| Heavy Atoms | 25 |
| Complexity | 825.53204 |
Chemical Identifiers
| CAS Number | 428480-98-2 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=N2)C)[N+](=O)[O-] |
Product Overview
4-ethoxy-N-[(6-methylpyridin-2-yl)carbamothioyl]-3-nitrobenzamide (CAS 428480-98-2), with molecular formula C16H16N4O4S and molecular weight 360.09 g/mol. IUPAC: 4-ethoxy-N-[(6-methyl-2-pyridinyl)carbamothioyl]-3-nitrobenzamide.
Chemical Property Profile of 4-ethoxy-N-[(6-methylpyridin-2-yl)carbamothioyl]-3-nitrobenzamide
Property Insights of 4-ethoxy-N-[(6-methylpyridin-2-yl)carbamothioyl]-3-nitrobenzamide
The XLogP value of 2.82372 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-ethoxy-N-[(6-methylpyridin-2-yl)carbamothioyl]-3-nitrobenzamide. The TPSA of 106.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-ethoxy-N-[(6-methylpyridin-2-yl)carbamothioyl]-3-nitrobenzamide. Following Lipinski's Rule of Five, 4-ethoxy-N-[(6-methylpyridin-2-yl)carbamothioyl]-3-nitrobenzamide has 2 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 4-ethoxy-N-[(6-methylpyridin-2-yl)carbamothioyl]-3-nitrobenzamide?
The CAS number of 4-ethoxy-N-[(6-methylpyridin-2-yl)carbamothioyl]-3-nitrobenzamide is 428480-98-2.
What is the molecular formula of 4-ethoxy-N-[(6-methylpyridin-2-yl)carbamothioyl]-3-nitrobenzamide?
The molecular formula of 4-ethoxy-N-[(6-methylpyridin-2-yl)carbamothioyl]-3-nitrobenzamide is C16H16N4O4S.
What is the molecular weight of 4-ethoxy-N-[(6-methylpyridin-2-yl)carbamothioyl]-3-nitrobenzamide?
The molecular weight of 4-ethoxy-N-[(6-methylpyridin-2-yl)carbamothioyl]-3-nitrobenzamide is 360.09 g/mol.
Where can I buy 4-ethoxy-N-[(6-methylpyridin-2-yl)carbamothioyl]-3-nitrobenzamide?
You can request a quote for 4-ethoxy-N-[(6-methylpyridin-2-yl)carbamothioyl]-3-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-ethoxy-N-[(6-methylpyridin-2-yl)carbamothioyl]-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-ethoxy-N-[(6-methylpyridin-2-yl)carbamothioyl]-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.