![4-ethoxy-N-[(3-methylphenyl)carbamothioyl]-3-nitrobenzamide structure](/static/products/4284/428478-83-5.webp)
4-ethoxy-N-[(3-methylphenyl)carbamothioyl]-3-nitrobenzamide
TL;DR: 4-ethoxy-N-[(3-methylphenyl)carbamothioyl]-3-nitrobenzamide (CAS 428478-83-5) is a chemical compound with molecular formula C17H17N3O4S and molecular weight 359.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethoxy-N-[(3-methylphenyl)carbamothioyl]-3-nitrobenzamide
Also Known As: 4-ethoxy-N-[(3-methylphenyl)carbamothioyl]-3-nitrobenzamide, AB00108551-01
| Molecular Formula | C17H17N3O4S |
|---|---|
| Molecular Weight | 359.09 g/mol |
| LogP | 3.42872 |
| Topological Polar Surface Area | 93.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 359.09396 |
| Heavy Atoms | 25 |
| Complexity | 823.2903 |
Chemical Identifiers
| CAS Number | 428478-83-5 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C)[N+](=O)[O-] |
Product Overview
4-ethoxy-N-[(3-methylphenyl)carbamothioyl]-3-nitrobenzamide (CAS 428478-83-5), with molecular formula C17H17N3O4S and molecular weight 359.09 g/mol. IUPAC: 4-ethoxy-N-[(3-methylphenyl)carbamothioyl]-3-nitrobenzamide.
Chemical Property Profile of 4-ethoxy-N-[(3-methylphenyl)carbamothioyl]-3-nitrobenzamide
Property Insights of 4-ethoxy-N-[(3-methylphenyl)carbamothioyl]-3-nitrobenzamide
The XLogP value of 3.42872 indicates that 4-ethoxy-N-[(3-methylphenyl)carbamothioyl]-3-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-ethoxy-N-[(3-methylphenyl)carbamothioyl]-3-nitrobenzamide. Following Lipinski's Rule of Five, 4-ethoxy-N-[(3-methylphenyl)carbamothioyl]-3-nitrobenzamide has 2 hydrogen bond donor(s) and 5 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-[(3-methylphenyl)carbamothioyl]-3-nitrobenzamide?
The CAS number of 4-ethoxy-N-[(3-methylphenyl)carbamothioyl]-3-nitrobenzamide is 428478-83-5.
What is the molecular formula of 4-ethoxy-N-[(3-methylphenyl)carbamothioyl]-3-nitrobenzamide?
The molecular formula of 4-ethoxy-N-[(3-methylphenyl)carbamothioyl]-3-nitrobenzamide is C17H17N3O4S.
What is the molecular weight of 4-ethoxy-N-[(3-methylphenyl)carbamothioyl]-3-nitrobenzamide?
The molecular weight of 4-ethoxy-N-[(3-methylphenyl)carbamothioyl]-3-nitrobenzamide is 359.09 g/mol.
Where can I buy 4-ethoxy-N-[(3-methylphenyl)carbamothioyl]-3-nitrobenzamide?
You can request a quote for 4-ethoxy-N-[(3-methylphenyl)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-[(3-methylphenyl)carbamothioyl]-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-ethoxy-N-[(3-methylphenyl)carbamothioyl]-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.