2-Oxo-N,5-diphenyl-1,3-oxazolidine-3-carboximidothioic acid
TL;DR: 2-Oxo-N,5-diphenyl-1,3-oxazolidine-3-carboximidothioic acid (CAS 57795-07-0) is a chemical compound with molecular formula C16H14N2O2S and molecular weight 298.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-oxo-N,5-diphenyl-1,3-oxazolidine-3-carbothioamide
Also Known As: N,5-Diphenyl-2-oxo-3-oxazolidinecarbothioamide, 3-Oxazolidinecarbothioamide, N,5-diphenyl-2-oxo-, Phenylaminothiocarbonyl-3 phenyl-5 oxazolidine-1,3 one-2, Phenylaminothiocarbonyl-3 phenyl-5 oxazolidine-1,3 one-2 [French], 2-oxo-N,5-diphenyl-1,3-oxazolidine-3-carbothioamide
| Molecular Formula | C16H14N2O2S |
|---|---|
| Molecular Weight | 298.08 g/mol |
| LogP | 3.5769 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 298.0776 |
| Heavy Atoms | 21 |
| Complexity | 645.84125 |
Chemical Identifiers
| CAS Number | 57795-07-0 |
|---|---|
| SMILES | C1C(OC(=O)N1C(=S)NC2=CC=CC=C2)C3=CC=CC=C3 |
Product Overview
2-Oxo-N,5-diphenyl-1,3-oxazolidine-3-carboximidothioic acid (CAS 57795-07-0), with molecular formula C16H14N2O2S and molecular weight 298.08 g/mol. IUPAC: 2-oxo-N,5-diphenyl-1,3-oxazolidine-3-carbothioamide.
Chemical Property Profile of 2-Oxo-N,5-diphenyl-1,3-oxazolidine-3-carboximidothioic acid
Property Insights of 2-Oxo-N,5-diphenyl-1,3-oxazolidine-3-carboximidothioic acid
The XLogP value of 3.5769 indicates that 2-Oxo-N,5-diphenyl-1,3-oxazolidine-3-carboximidothioic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.57 Ų, 2-Oxo-N,5-diphenyl-1,3-oxazolidine-3-carboximidothioic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Oxo-N,5-diphenyl-1,3-oxazolidine-3-carboximidothioic acid 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 2-Oxo-N,5-diphenyl-1,3-oxazolidine-3-carboximidothioic acid?
The CAS number of 2-Oxo-N,5-diphenyl-1,3-oxazolidine-3-carboximidothioic acid is 57795-07-0.
What is the molecular formula of 2-Oxo-N,5-diphenyl-1,3-oxazolidine-3-carboximidothioic acid?
The molecular formula of 2-Oxo-N,5-diphenyl-1,3-oxazolidine-3-carboximidothioic acid is C16H14N2O2S.
What is the molecular weight of 2-Oxo-N,5-diphenyl-1,3-oxazolidine-3-carboximidothioic acid?
The molecular weight of 2-Oxo-N,5-diphenyl-1,3-oxazolidine-3-carboximidothioic acid is 298.08 g/mol.
Where can I buy 2-Oxo-N,5-diphenyl-1,3-oxazolidine-3-carboximidothioic acid?
You can request a quote for 2-Oxo-N,5-diphenyl-1,3-oxazolidine-3-carboximidothioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Oxo-N,5-diphenyl-1,3-oxazolidine-3-carboximidothioic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxo-N,5-diphenyl-1,3-oxazolidine-3-carboximidothioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.