![5-[(4-fluoroanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione structure](/static/products/573/573932-89-5.png)
5-[(4-fluoroanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione
TL;DR: 5-[(4-fluoroanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 573932-89-5) is a chemical compound with molecular formula C21H14FN3O2S and molecular weight 391.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-fluorophenyl)iminomethyl]-6-hydroxy-1-naphthalen-1-yl-2-sulfanylidenepyrimidin-4-one
Also Known As: 5-[(4-fluoroanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione, (5E)-5-[(4-fluoroanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione, (5Z)-5-[(4-fluoroanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione, (5Z)-5-{[(4-fluorophenyl)amino]methylidene}-1-(naphthalen-1-yl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione, (Z)-5-(((4-fluorophenyl)amino)methylene)-1-(naphthalen-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
| Molecular Formula | C21H14FN3O2S |
|---|---|
| Molecular Weight | 391.08 g/mol |
| LogP | 4.64359 |
| Topological Polar Surface Area | 70.38 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 391.07907 |
| Heavy Atoms | 28 |
| Complexity | 1319.055 |
Chemical Identifiers
| CAS Number | 573932-89-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2N3C(=C(C(=O)NC3=S)C=NC4=CC=C(C=C4)F)O |
Product Overview
5-[(4-fluoroanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 573932-89-5), with molecular formula C21H14FN3O2S and molecular weight 391.08 g/mol. IUPAC: 5-[(4-fluorophenyl)iminomethyl]-6-hydroxy-1-naphthalen-1-yl-2-sulfanylidenepyrimidin-4-one.
Chemical Property Profile of 5-[(4-fluoroanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione
Property Insights of 5-[(4-fluoroanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione
The XLogP value of 4.64359 indicates that 5-[(4-fluoroanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.38 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(4-fluoroanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione. Following Lipinski's Rule of Five, 5-[(4-fluoroanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione has 2 hydrogen bond donor(s) and 4 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 5-[(4-fluoroanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione?
The CAS number of 5-[(4-fluoroanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione is 573932-89-5.
What is the molecular formula of 5-[(4-fluoroanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular formula of 5-[(4-fluoroanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione is C21H14FN3O2S.
What is the molecular weight of 5-[(4-fluoroanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular weight of 5-[(4-fluoroanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione is 391.08 g/mol.
Where can I buy 5-[(4-fluoroanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione?
You can request a quote for 5-[(4-fluoroanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(4-fluoroanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-[(4-fluoroanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.