![N-[(3-chloro-4-morpholin-4-ylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide structure](/static/products/4284/428470-45-5.webp)
N-[(3-chloro-4-morpholin-4-ylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide
TL;DR: N-[(3-chloro-4-morpholin-4-ylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide (CAS 428470-45-5) is a chemical compound with molecular formula C20H21ClN4O5S and molecular weight 464.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-chloro-4-morpholin-4-ylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide
Also Known As: N-[(3-chloro-4-morpholin-4-ylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide, N-({[3-chloro-4-(4-morpholinyl)phenyl]amino}carbonothioyl)-4-ethoxy-3-nitrobenzamide, N-{[3-chloro-4-(morpholin-4-yl)phenyl]carbamothioyl}-4-ethoxy-3-nitrobenzamide, N-[(3-chloro-4-morpholino-phenyl)thiocarbamoyl]-4-ethoxy-3-nitro-benzamide, 1-[3-CHLORO-4-(MORPHOLIN-4-YL)PHENYL]-3-(4-ETHOXY-3-NITROBENZOYL)THIOUREA
| Molecular Formula | C20H21ClN4O5S |
|---|---|
| Molecular Weight | 464.09 g/mol |
| LogP | 3.6103 |
| Topological Polar Surface Area | 105.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 464.09213 |
| Heavy Atoms | 31 |
| Complexity | 997.53064 |
Chemical Identifiers
| CAS Number | 428470-45-5 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)N3CCOCC3)Cl)[N+](=O)[O-] |
Product Overview
N-[(3-chloro-4-morpholin-4-ylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide (CAS 428470-45-5), with molecular formula C20H21ClN4O5S and molecular weight 464.09 g/mol. IUPAC: N-[(3-chloro-4-morpholin-4-ylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide.
Chemical Property Profile of N-[(3-chloro-4-morpholin-4-ylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide
Property Insights of N-[(3-chloro-4-morpholin-4-ylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide
The XLogP value of 3.6103 indicates that N-[(3-chloro-4-morpholin-4-ylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.97 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(3-chloro-4-morpholin-4-ylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide. Following Lipinski's Rule of Five, N-[(3-chloro-4-morpholin-4-ylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide has 2 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 N-[(3-chloro-4-morpholin-4-ylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide?
The CAS number of N-[(3-chloro-4-morpholin-4-ylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide is 428470-45-5.
What is the molecular formula of N-[(3-chloro-4-morpholin-4-ylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide?
The molecular formula of N-[(3-chloro-4-morpholin-4-ylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide is C20H21ClN4O5S.
What is the molecular weight of N-[(3-chloro-4-morpholin-4-ylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide?
The molecular weight of N-[(3-chloro-4-morpholin-4-ylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide is 464.09 g/mol.
Where can I buy N-[(3-chloro-4-morpholin-4-ylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide?
You can request a quote for N-[(3-chloro-4-morpholin-4-ylphenyl)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-[(3-chloro-4-morpholin-4-ylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(3-chloro-4-morpholin-4-ylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.