1-(Furfurylideneamino)-3-(3-indolylacetyl)-2-thiobarbituric acid
TL;DR: 1-(Furfurylideneamino)-3-(3-indolylacetyl)-2-thiobarbituric acid (CAS 161806-27-5) is a chemical compound with molecular formula C19H14N4O4S and molecular weight 394.07358 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(E)-furan-2-ylmethylideneamino]-3-[2-(1H-indol-3-yl)acetyl]-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: Barbituric acid, 1-(furfurylideneamino)-3-(3-indolylacetyl)-2-thio-, 1-(Furfurylideneamino)-3-(3-indolylacetyl)-2-thiobarbituric acid, 4,6(1H,3H)-Pyrimidinedione, dihydro-1-((2-furanylmethylene)amino)-3-(1H-indol-3-ylacetyl)-2-thioxo-, 1-[(2-Furanylmethylene)amino]-2-thioxo-3-[(1H-indol-3-yl)acetyl]-2,3-dihydropyrimidine-4,6(1H,5H)-dione, 1-{[(furan-2-yl)methylidene]amino}-3-[2-(1H-indol-3-yl)acetyl]-2-sulfanylidene-1,3-diazinane-4,6-dione
Technical Specifications
| Molecular Formula | C19H14N4O4S |
| Molecular Weight | 394.07358 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 131.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 394.07358 Da |
| Heavy Atoms | 28 |
| Complexity | 712.0 |
| SMILES | C1C(=O)N(C(=S)N(C1=O)/N=C/C2=CC=CO2)C(=O)CC3=CNC4=CC=CC=C43 |
| InChIKey | LQAZNOWGAGTOSY-SRZZPIQSSA-N |
Chemical Property Profile of 1-(Furfurylideneamino)-3-(3-indolylacetyl)-2-thiobarbituric acid
Property Insights of 1-(Furfurylideneamino)-3-(3-indolylacetyl)-2-thiobarbituric acid
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Furfurylideneamino)-3-(3-indolylacetyl)-2-thiobarbituric acid. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Furfurylideneamino)-3-(3-indolylacetyl)-2-thiobarbituric acid. Following Lipinski's Rule of Five, 1-(Furfurylideneamino)-3-(3-indolylacetyl)-2-thiobarbituric acid has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(Furfurylideneamino)-3-(3-indolylacetyl)-2-thiobarbituric acid?
The CAS number of 1-(Furfurylideneamino)-3-(3-indolylacetyl)-2-thiobarbituric acid is 161806-27-5.
What is the molecular formula of 1-(Furfurylideneamino)-3-(3-indolylacetyl)-2-thiobarbituric acid?
The molecular formula of 1-(Furfurylideneamino)-3-(3-indolylacetyl)-2-thiobarbituric acid is C19H14N4O4S.
What is the molecular weight of 1-(Furfurylideneamino)-3-(3-indolylacetyl)-2-thiobarbituric acid?
The molecular weight of 1-(Furfurylideneamino)-3-(3-indolylacetyl)-2-thiobarbituric acid is 394.07358 g/mol.
Where can I buy 1-(Furfurylideneamino)-3-(3-indolylacetyl)-2-thiobarbituric acid?
You can request a quote for 1-(Furfurylideneamino)-3-(3-indolylacetyl)-2-thiobarbituric acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(Furfurylideneamino)-3-(3-indolylacetyl)-2-thiobarbituric acid?
Yes, CoreyChem provides custom synthesis services for 1-(Furfurylideneamino)-3-(3-indolylacetyl)-2-thiobarbituric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.