N-(4-Oxo-2-phenyl-1,3-thiazolidin-3-yl)carbamimidothioic acid
TL;DR: N-(4-Oxo-2-phenyl-1,3-thiazolidin-3-yl)carbamimidothioic acid (CAS 130111-89-6) is a chemical compound with molecular formula C10H11N3OS2 and molecular weight 253.03435 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-oxo-2-phenyl-1,3-thiazolidin-3-yl)thiourea
Also Known As: (4-Oxo-2-phenyl-3-thiazolidinyl)thiourea, Thiourea, (4-oxo-2-phenyl-3-thiazolidinyl)-, (4-oxo-2-phenyl-1,3-thiazolidin-3-yl)thiourea, 2-phenyl-(4-oxothiazolidine-3-yl)thiourea, N-(4-Oxo-2-phenyl-1,3-thiazolidin-3-yl)carbamimidothioic acid
Technical Specifications
| Molecular Formula | C10H11N3OS2 |
| Molecular Weight | 253.03435 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 116.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 253.03435 Da |
| Heavy Atoms | 16 |
| Complexity | 292.0 |
| SMILES | C1C(=O)N(C(S1)C2=CC=CC=C2)NC(=S)N |
| InChIKey | XBDKJIBMTFJBRB-UHFFFAOYSA-N |
Chemical Property Profile of N-(4-Oxo-2-phenyl-1,3-thiazolidin-3-yl)carbamimidothioic acid
Property Insights of N-(4-Oxo-2-phenyl-1,3-thiazolidin-3-yl)carbamimidothioic acid
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-Oxo-2-phenyl-1,3-thiazolidin-3-yl)carbamimidothioic acid. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-Oxo-2-phenyl-1,3-thiazolidin-3-yl)carbamimidothioic acid. Following Lipinski's Rule of Five, N-(4-Oxo-2-phenyl-1,3-thiazolidin-3-yl)carbamimidothioic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(4-Oxo-2-phenyl-1,3-thiazolidin-3-yl)carbamimidothioic acid?
The CAS number of N-(4-Oxo-2-phenyl-1,3-thiazolidin-3-yl)carbamimidothioic acid is 130111-89-6.
What is the molecular formula of N-(4-Oxo-2-phenyl-1,3-thiazolidin-3-yl)carbamimidothioic acid?
The molecular formula of N-(4-Oxo-2-phenyl-1,3-thiazolidin-3-yl)carbamimidothioic acid is C10H11N3OS2.
What is the molecular weight of N-(4-Oxo-2-phenyl-1,3-thiazolidin-3-yl)carbamimidothioic acid?
The molecular weight of N-(4-Oxo-2-phenyl-1,3-thiazolidin-3-yl)carbamimidothioic acid is 253.03435 g/mol.
Where can I buy N-(4-Oxo-2-phenyl-1,3-thiazolidin-3-yl)carbamimidothioic acid?
You can request a quote for N-(4-Oxo-2-phenyl-1,3-thiazolidin-3-yl)carbamimidothioic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(4-Oxo-2-phenyl-1,3-thiazolidin-3-yl)carbamimidothioic acid?
Yes, CoreyChem provides custom synthesis services for N-(4-Oxo-2-phenyl-1,3-thiazolidin-3-yl)carbamimidothioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.