1-Phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione
TL;DR: 1-Phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 15112-10-4) is a chemical compound with molecular formula C10H8N2O2S and molecular weight 220.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: N-phenylthiobarbituric acid, 1-phenyl-2-thiobarbituric acid, 1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione, BIM-0037516.P001, 1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
| Molecular Formula | C10H8N2O2S |
|---|---|
| Molecular Weight | 220.03 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 81.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 220.03065 |
| Heavy Atoms | 15 |
| Complexity | 311.0 |
Chemical Identifiers
| CAS Number | 15112-10-4 |
|---|---|
| SMILES | C1C(=O)NC(=S)N(C1=O)C2=CC=CC=C2 |
| InChIKey | NPXACSUWYDROMZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 15112-10-4), with molecular formula C10H8N2O2S and molecular weight 220.03 g/mol. IUPAC: 1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of 1-Phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Property Insights of 1-Phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione. The TPSA of 81.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione. Following Lipinski's Rule of Five, 1-Phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione has 1 hydrogen bond donor(s) and 3 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 1-Phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
The CAS number of 1-Phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione is 15112-10-4.
What is the molecular formula of 1-Phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular formula of 1-Phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione is C10H8N2O2S.
What is the molecular weight of 1-Phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular weight of 1-Phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione is 220.03 g/mol.
Where can I buy 1-Phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
You can request a quote for 1-Phenyl-2-sulfanylidene-1,3-diazinane-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 1-Phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.