![(5Z)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione structure](/static/products/577/577983-05-2.png)
(5Z)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
TL;DR: (5Z)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione (CAS 577983-05-2) is a chemical compound with molecular formula C21H18N4O2S and molecular weight 390.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroxy-5-[2-(1H-indol-3-yl)ethyliminomethyl]-1-phenyl-2-sulfanylidenepyrimidin-4-one
Also Known As: (5Z)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, 5-[[2-(1H-indol-3-yl)ethylamino]methylidene]-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione, (5Z)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1-phenyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione, (5Z)-5-[[2-(1H-indol-3-yl)ethylamino]methylidene]-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione, (Z)-5-(((2-(1H-indol-3-yl)ethyl)amino)methylene)-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
| Molecular Formula | C21H18N4O2S |
|---|---|
| Molecular Weight | 390.12 g/mol |
| LogP | 3.74359 |
| Topological Polar Surface Area | 86.17 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 390.11505 |
| Heavy Atoms | 28 |
| Complexity | 1269.0504 |
Chemical Identifiers
| CAS Number | 577983-05-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=C(C(=O)NC2=S)C=NCCC3=CNC4=CC=CC=C43)O |
Product Overview
(5Z)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione (CAS 577983-05-2), with molecular formula C21H18N4O2S and molecular weight 390.12 g/mol. IUPAC: 6-hydroxy-5-[2-(1H-indol-3-yl)ethyliminomethyl]-1-phenyl-2-sulfanylidenepyrimidin-4-one.
Chemical Property Profile of (5Z)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Property Insights of (5Z)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
The XLogP value of 3.74359 indicates that (5Z)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.17 Ų falls within the moderate polarity range, balancing permeability and solubility for (5Z)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione. Following Lipinski's Rule of Five, (5Z)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione has 3 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 (5Z)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione?
The CAS number of (5Z)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione is 577983-05-2.
What is the molecular formula of (5Z)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione?
The molecular formula of (5Z)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione is C21H18N4O2S.
What is the molecular weight of (5Z)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione?
The molecular weight of (5Z)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione is 390.12 g/mol.
Where can I buy (5Z)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione?
You can request a quote for (5Z)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1-phenyl-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 (5Z)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione?
Yes, KEHONG BIO provides custom synthesis services for (5Z)-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.