4-Phenylthiomorpholine-3,5-dione
TL;DR: 4-Phenylthiomorpholine-3,5-dione (CAS 130968-47-7) is a chemical compound with molecular formula C10H9NO2S and molecular weight 207.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-phenylthiomorpholine-3,5-dione
Also Known As: 4-phenylthiomorpholine-3,5-dione, 4-phenyl-3,5-thiomorpholinedione, Bionet2_000257, 4-phenyltetrahydro-1,4-thiazine-3,5-dione
| Molecular Formula | C10H9NO2S |
|---|---|
| Molecular Weight | 207.04 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 62.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 207.0354 |
| Heavy Atoms | 14 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 130968-47-7 |
|---|---|
| SMILES | C1C(=O)N(C(=O)CS1)C2=CC=CC=C2 |
| InChIKey | HTTJKKGJGRZWDM-UHFFFAOYSA-N |
Product Overview
4-Phenylthiomorpholine-3,5-dione (CAS 130968-47-7), with molecular formula C10H9NO2S and molecular weight 207.04 g/mol. IUPAC: 4-phenylthiomorpholine-3,5-dione.
Chemical Property Profile of 4-Phenylthiomorpholine-3,5-dione
Property Insights of 4-Phenylthiomorpholine-3,5-dione
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Phenylthiomorpholine-3,5-dione. The TPSA of 62.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Phenylthiomorpholine-3,5-dione. Following Lipinski's Rule of Five, 4-Phenylthiomorpholine-3,5-dione has 0 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 4-Phenylthiomorpholine-3,5-dione?
The CAS number of 4-Phenylthiomorpholine-3,5-dione is 130968-47-7.
What is the molecular formula of 4-Phenylthiomorpholine-3,5-dione?
The molecular formula of 4-Phenylthiomorpholine-3,5-dione is C10H9NO2S.
What is the molecular weight of 4-Phenylthiomorpholine-3,5-dione?
The molecular weight of 4-Phenylthiomorpholine-3,5-dione is 207.04 g/mol.
Where can I buy 4-Phenylthiomorpholine-3,5-dione?
You can request a quote for 4-Phenylthiomorpholine-3,5-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Phenylthiomorpholine-3,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 4-Phenylthiomorpholine-3,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.