![N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-4-nitrobenzamide structure](/static/products/5288/528889-11-4.webp)
N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-4-nitrobenzamide
TL;DR: N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-4-nitrobenzamide (CAS 528889-11-4) is a chemical compound with molecular formula C18H18N4O4S and molecular weight 386.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-morpholin-4-ylphenyl)carbamothioyl]-4-nitrobenzamide
Also Known As: N-[(2-morpholin-4-ylphenyl)carbamothioyl]-4-nitrobenzamide, N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-4-nitrobenzamide, N-{[2-(morpholin-4-yl)phenyl]carbamothioyl}-4-nitrobenzamide, 3-[2-(MORPHOLIN-4-YL)PHENYL]-1-(4-NITROBENZOYL)THIOUREA, N-({[2-(4-morpholinyl)phenyl]amino}carbonothioyl)-4-nitrobenzamide
| Molecular Formula | C18H18N4O4S |
|---|---|
| Molecular Weight | 386.10 g/mol |
| LogP | 2.5582 |
| Topological Polar Surface Area | 96.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 386.1049 |
| Heavy Atoms | 27 |
| Complexity | 850.69507 |
Chemical Identifiers
| CAS Number | 528889-11-4 |
|---|---|
| SMILES | C1COCCN1C2=CC=CC=C2NC(=S)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-4-nitrobenzamide (CAS 528889-11-4), with molecular formula C18H18N4O4S and molecular weight 386.10 g/mol. IUPAC: N-[(2-morpholin-4-ylphenyl)carbamothioyl]-4-nitrobenzamide.
Chemical Property Profile of N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-4-nitrobenzamide
Property Insights of N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-4-nitrobenzamide
The XLogP value of 2.5582 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-4-nitrobenzamide. The TPSA of 96.74 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-4-nitrobenzamide. Following Lipinski's Rule of Five, N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-4-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-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-4-nitrobenzamide?
The CAS number of N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-4-nitrobenzamide is 528889-11-4.
What is the molecular formula of N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-4-nitrobenzamide?
The molecular formula of N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-4-nitrobenzamide is C18H18N4O4S.
What is the molecular weight of N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-4-nitrobenzamide?
The molecular weight of N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-4-nitrobenzamide is 386.10 g/mol.
Where can I buy N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-4-nitrobenzamide?
You can request a quote for N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-4-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-4-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-4-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.