4-(4-Chlorophenyl)-3,5-thiomorpholinedione
TL;DR: 4-(4-Chlorophenyl)-3,5-thiomorpholinedione (CAS 338409-06-6) is a chemical compound with molecular formula C10H8ClNO2S and molecular weight 241.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-chlorophenyl)thiomorpholine-3,5-dione
Also Known As: 4-(4-Chlorophenyl)-3,5-thiomorpholinedione, 4-(4-chlorophenyl)thiomorpholine-3,5-dione, 4-(4-Chlorophenyl)-3,5-thiomorpholinedione #, BRD-K30864063-001-01-0, 1,4-Thiazine-3,5-dione, perhydro-4-(4-chlorophenyl)-
| Molecular Formula | C10H8ClNO2S |
|---|---|
| Molecular Weight | 241.00 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 62.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 240.99643 |
| Heavy Atoms | 15 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 338409-06-6 |
|---|---|
| SMILES | C1C(=O)N(C(=O)CS1)C2=CC=C(C=C2)Cl |
| InChIKey | QRIYKFWVJLGAJD-UHFFFAOYSA-N |
Product Overview
4-(4-Chlorophenyl)-3,5-thiomorpholinedione (CAS 338409-06-6), with molecular formula C10H8ClNO2S and molecular weight 241.00 g/mol. IUPAC: 4-(4-chlorophenyl)thiomorpholine-3,5-dione.
Chemical Property Profile of 4-(4-Chlorophenyl)-3,5-thiomorpholinedione
Property Insights of 4-(4-Chlorophenyl)-3,5-thiomorpholinedione
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Chlorophenyl)-3,5-thiomorpholinedione. The TPSA of 62.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Chlorophenyl)-3,5-thiomorpholinedione. Following Lipinski's Rule of Five, 4-(4-Chlorophenyl)-3,5-thiomorpholinedione 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-(4-Chlorophenyl)-3,5-thiomorpholinedione?
The CAS number of 4-(4-Chlorophenyl)-3,5-thiomorpholinedione is 338409-06-6.
What is the molecular formula of 4-(4-Chlorophenyl)-3,5-thiomorpholinedione?
The molecular formula of 4-(4-Chlorophenyl)-3,5-thiomorpholinedione is C10H8ClNO2S.
What is the molecular weight of 4-(4-Chlorophenyl)-3,5-thiomorpholinedione?
The molecular weight of 4-(4-Chlorophenyl)-3,5-thiomorpholinedione is 241.00 g/mol.
Where can I buy 4-(4-Chlorophenyl)-3,5-thiomorpholinedione?
You can request a quote for 4-(4-Chlorophenyl)-3,5-thiomorpholinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Chlorophenyl)-3,5-thiomorpholinedione?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Chlorophenyl)-3,5-thiomorpholinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.