(Z)-5-(((4-ethoxyphenyl)amino)methylene)-1-(naphthalen-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
TL;DR: (Z)-5-(((4-ethoxyphenyl)amino)methylene)-1-(naphthalen-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione (CAS 577997-01-4) is a chemical compound with molecular formula C23H19N3O3S and molecular weight 417.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-ethoxyphenyl)iminomethyl]-6-hydroxy-1-naphthalen-1-yl-2-sulfanylidenepyrimidin-4-one
Also Known As: (Z)-5-(((4-ethoxyphenyl)amino)methylene)-1-(naphthalen-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, 5-[(4-ethoxyanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione, (5Z)-5-[(4-ethoxyanilino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione, (5Z)-5-{[(4-ethoxyphenyl)amino]methylidene}-1-(naphthalen-1-yl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
| Molecular Formula | C23H19N3O3S |
|---|---|
| Molecular Weight | 417.11 g/mol |
| LogP | 4.90319 |
| Topological Polar Surface Area | 79.61 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.11472 |
| Heavy Atoms | 30 |
| Complexity | 1349.7322 |
Chemical Identifiers
| CAS Number | 577997-01-4 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N=CC2=C(N(C(=S)NC2=O)C3=CC=CC4=CC=CC=C43)O |
Product Overview
(Z)-5-(((4-ethoxyphenyl)amino)methylene)-1-(naphthalen-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione (CAS 577997-01-4), with molecular formula C23H19N3O3S and molecular weight 417.11 g/mol. IUPAC: 5-[(4-ethoxyphenyl)iminomethyl]-6-hydroxy-1-naphthalen-1-yl-2-sulfanylidenepyrimidin-4-one.
Chemical Property Profile of (Z)-5-(((4-ethoxyphenyl)amino)methylene)-1-(naphthalen-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Property Insights of (Z)-5-(((4-ethoxyphenyl)amino)methylene)-1-(naphthalen-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
The XLogP value of 4.90319 indicates that (Z)-5-(((4-ethoxyphenyl)amino)methylene)-1-(naphthalen-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.61 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-5-(((4-ethoxyphenyl)amino)methylene)-1-(naphthalen-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione. Following Lipinski's Rule of Five, (Z)-5-(((4-ethoxyphenyl)amino)methylene)-1-(naphthalen-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione 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 (Z)-5-(((4-ethoxyphenyl)amino)methylene)-1-(naphthalen-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione?
The CAS number of (Z)-5-(((4-ethoxyphenyl)amino)methylene)-1-(naphthalen-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione is 577997-01-4.
What is the molecular formula of (Z)-5-(((4-ethoxyphenyl)amino)methylene)-1-(naphthalen-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione?
The molecular formula of (Z)-5-(((4-ethoxyphenyl)amino)methylene)-1-(naphthalen-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione is C23H19N3O3S.
What is the molecular weight of (Z)-5-(((4-ethoxyphenyl)amino)methylene)-1-(naphthalen-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione?
The molecular weight of (Z)-5-(((4-ethoxyphenyl)amino)methylene)-1-(naphthalen-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione is 417.11 g/mol.
Where can I buy (Z)-5-(((4-ethoxyphenyl)amino)methylene)-1-(naphthalen-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione?
You can request a quote for (Z)-5-(((4-ethoxyphenyl)amino)methylene)-1-(naphthalen-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-5-(((4-ethoxyphenyl)amino)methylene)-1-(naphthalen-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione?
Yes, KEHONG BIO provides custom synthesis services for (Z)-5-(((4-ethoxyphenyl)amino)methylene)-1-(naphthalen-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.