5-(Indolinylmethylene)-2-thioxo-1,3-dihydropyrimidine-4,6-dione
TL;DR: 5-(Indolinylmethylene)-2-thioxo-1,3-dihydropyrimidine-4,6-dione (CAS 712307-74-9) is a chemical compound with molecular formula C13H11N3O2S and molecular weight 273.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2,3-dihydroindol-1-ylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: F1855-0024, 5-(indolinylmethylene)-2-thioxo-1,3-dihydropyrimidine-4,6-dione, 5-(2,3-dihydroindol-1-ylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione, 5-[(1-indolinyl)methylene]-2-thioxohexahydro-4,6-pyrimidinedione, 5-[(2,3-dihydro-1H-indol-1-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
| Molecular Formula | C13H11N3O2S |
|---|---|
| Molecular Weight | 273.06 g/mol |
| LogP | 0.4639 |
| Topological Polar Surface Area | 61.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 273.0572 |
| Heavy Atoms | 19 |
| Complexity | 602.0693 |
Chemical Identifiers
| CAS Number | 712307-74-9 |
|---|---|
| SMILES | C1CN(C2=CC=CC=C21)C=C3C(=O)NC(=S)NC3=O |
Product Overview
5-(Indolinylmethylene)-2-thioxo-1,3-dihydropyrimidine-4,6-dione (CAS 712307-74-9), with molecular formula C13H11N3O2S and molecular weight 273.06 g/mol. IUPAC: 5-(2,3-dihydroindol-1-ylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of 5-(Indolinylmethylene)-2-thioxo-1,3-dihydropyrimidine-4,6-dione
Property Insights of 5-(Indolinylmethylene)-2-thioxo-1,3-dihydropyrimidine-4,6-dione
The XLogP value of 0.4639 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Indolinylmethylene)-2-thioxo-1,3-dihydropyrimidine-4,6-dione. The TPSA of 61.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(Indolinylmethylene)-2-thioxo-1,3-dihydropyrimidine-4,6-dione. Following Lipinski's Rule of Five, 5-(Indolinylmethylene)-2-thioxo-1,3-dihydropyrimidine-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-(Indolinylmethylene)-2-thioxo-1,3-dihydropyrimidine-4,6-dione?
The CAS number of 5-(Indolinylmethylene)-2-thioxo-1,3-dihydropyrimidine-4,6-dione is 712307-74-9.
What is the molecular formula of 5-(Indolinylmethylene)-2-thioxo-1,3-dihydropyrimidine-4,6-dione?
The molecular formula of 5-(Indolinylmethylene)-2-thioxo-1,3-dihydropyrimidine-4,6-dione is C13H11N3O2S.
What is the molecular weight of 5-(Indolinylmethylene)-2-thioxo-1,3-dihydropyrimidine-4,6-dione?
The molecular weight of 5-(Indolinylmethylene)-2-thioxo-1,3-dihydropyrimidine-4,6-dione is 273.06 g/mol.
Where can I buy 5-(Indolinylmethylene)-2-thioxo-1,3-dihydropyrimidine-4,6-dione?
You can request a quote for 5-(Indolinylmethylene)-2-thioxo-1,3-dihydropyrimidine-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-(Indolinylmethylene)-2-thioxo-1,3-dihydropyrimidine-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-(Indolinylmethylene)-2-thioxo-1,3-dihydropyrimidine-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.