![N-[(5-chloropyridin-2-yl)carbamothioyl]-4-ethoxy-3-nitrobenzamide structure](/static/products/4284/428485-02-3.webp)
N-[(5-chloropyridin-2-yl)carbamothioyl]-4-ethoxy-3-nitrobenzamide
TL;DR: N-[(5-chloropyridin-2-yl)carbamothioyl]-4-ethoxy-3-nitrobenzamide (CAS 428485-02-3) is a chemical compound with molecular formula C15H13ClN4O4S and molecular weight 380.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5-chloro-2-pyridinyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide
Also Known As: AB00108664-01, N-[(5-chloropyridin-2-yl)carbamothioyl]-4-ethoxy-3-nitrobenzamide
| Molecular Formula | C15H13ClN4O4S |
|---|---|
| Molecular Weight | 380.03 g/mol |
| LogP | 3.1687 |
| Topological Polar Surface Area | 106.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 380.0346 |
| Heavy Atoms | 25 |
| Complexity | 813.6787 |
Chemical Identifiers
| CAS Number | 428485-02-3 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC=C(C=C2)Cl)[N+](=O)[O-] |
Product Overview
N-[(5-chloropyridin-2-yl)carbamothioyl]-4-ethoxy-3-nitrobenzamide (CAS 428485-02-3), with molecular formula C15H13ClN4O4S and molecular weight 380.03 g/mol. IUPAC: N-[(5-chloro-2-pyridinyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide.
Chemical Property Profile of N-[(5-chloropyridin-2-yl)carbamothioyl]-4-ethoxy-3-nitrobenzamide
Property Insights of N-[(5-chloropyridin-2-yl)carbamothioyl]-4-ethoxy-3-nitrobenzamide
The XLogP value of 3.1687 indicates that N-[(5-chloropyridin-2-yl)carbamothioyl]-4-ethoxy-3-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.39 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(5-chloropyridin-2-yl)carbamothioyl]-4-ethoxy-3-nitrobenzamide. Following Lipinski's Rule of Five, N-[(5-chloropyridin-2-yl)carbamothioyl]-4-ethoxy-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 N-[(5-chloropyridin-2-yl)carbamothioyl]-4-ethoxy-3-nitrobenzamide?
The CAS number of N-[(5-chloropyridin-2-yl)carbamothioyl]-4-ethoxy-3-nitrobenzamide is 428485-02-3.
What is the molecular formula of N-[(5-chloropyridin-2-yl)carbamothioyl]-4-ethoxy-3-nitrobenzamide?
The molecular formula of N-[(5-chloropyridin-2-yl)carbamothioyl]-4-ethoxy-3-nitrobenzamide is C15H13ClN4O4S.
What is the molecular weight of N-[(5-chloropyridin-2-yl)carbamothioyl]-4-ethoxy-3-nitrobenzamide?
The molecular weight of N-[(5-chloropyridin-2-yl)carbamothioyl]-4-ethoxy-3-nitrobenzamide is 380.03 g/mol.
Where can I buy N-[(5-chloropyridin-2-yl)carbamothioyl]-4-ethoxy-3-nitrobenzamide?
You can request a quote for N-[(5-chloropyridin-2-yl)carbamothioyl]-4-ethoxy-3-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(5-chloropyridin-2-yl)carbamothioyl]-4-ethoxy-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(5-chloropyridin-2-yl)carbamothioyl]-4-ethoxy-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.