![5-({[2-(1H-indol-3-yl)ethyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione structure](/static/products/370/370076-79-2.png)
5-({[2-(1H-indol-3-yl)ethyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
TL;DR: 5-({[2-(1H-indol-3-yl)ethyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione (CAS 370076-79-2) is a chemical compound with molecular formula C15H14N4O2S and molecular weight 314.08 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]-2-sulfanylidene-1H-pyrimidin-4-one
Also Known As: 5-({[2-(1H-indol-3-yl)ethyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione, 5-(((2-(1H-indol-3-yl)ethyl)amino)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, 5-[[2-(1H-indol-3-yl)ethylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione, 5-{[(2-indol-3-ylethyl)amino]methylene}-2-thioxo-1,3-dihydropyrimidine-4,6-dio ne, (5E)-6-hydroxy-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-2-sulfanylpyrimidin-4(5H)-one
| Molecular Formula | C15H14N4O2S |
|---|---|
| Molecular Weight | 314.08 g/mol |
| LogP | 2.28099 |
| Topological Polar Surface Area | 97.03 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 314.08374 |
| Heavy Atoms | 22 |
| Complexity | 951.8211 |
Chemical Identifiers
| CAS Number | 370076-79-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)CCN=CC3=C(NC(=S)NC3=O)O |
Product Overview
5-({[2-(1H-indol-3-yl)ethyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione (CAS 370076-79-2), with molecular formula C15H14N4O2S and molecular weight 314.08 g/mol. IUPAC: 6-hydroxy-5-[2-(1H-indol-3-yl)ethyliminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one.
Chemical Property Profile of 5-({[2-(1H-indol-3-yl)ethyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Property Insights of 5-({[2-(1H-indol-3-yl)ethyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
The XLogP value of 2.28099 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-({[2-(1H-indol-3-yl)ethyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione. The TPSA of 97.03 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-({[2-(1H-indol-3-yl)ethyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione. Following Lipinski's Rule of Five, 5-({[2-(1H-indol-3-yl)ethyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione has 4 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-({[2-(1H-indol-3-yl)ethyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione?
The CAS number of 5-({[2-(1H-indol-3-yl)ethyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione is 370076-79-2.
What is the molecular formula of 5-({[2-(1H-indol-3-yl)ethyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione?
The molecular formula of 5-({[2-(1H-indol-3-yl)ethyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione is C15H14N4O2S.
What is the molecular weight of 5-({[2-(1H-indol-3-yl)ethyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione?
The molecular weight of 5-({[2-(1H-indol-3-yl)ethyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione is 314.08 g/mol.
Where can I buy 5-({[2-(1H-indol-3-yl)ethyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione?
You can request a quote for 5-({[2-(1H-indol-3-yl)ethyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-({[2-(1H-indol-3-yl)ethyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione?
Yes, KEHONG BIO provides custom synthesis services for 5-({[2-(1H-indol-3-yl)ethyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.