Ethanone, 2-(morpholin-4-yl)-1-phenyl-2-thioxo-
TL;DR: Ethanone, 2-(morpholin-4-yl)-1-phenyl-2-thioxo- (CAS 55548-41-9) is a chemical compound with molecular formula C12H13NO2S and molecular weight 235.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-morpholin-4-yl-1-phenyl-2-sulfanylideneethanone
Also Known As: 4-(Benzoylthiocarbonyl)morpholine, Ethanone, 2-(morpholin-4-yl)-1-phenyl-2-thioxo-, 1-Phenyl-2-morpholino-2-thioxoethanone, 1-Phenyl-2-thioxo-2-morpholinoethanone, 2-morpholin-4-yl-1-phenyl-2-sulfanylideneethanone
| Molecular Formula | C12H13NO2S |
|---|---|
| Molecular Weight | 235.07 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 61.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.0667 |
| Heavy Atoms | 16 |
| Complexity | 268.0 |
Chemical Identifiers
| CAS Number | 55548-41-9 |
|---|---|
| SMILES | C1COCCN1C(=S)C(=O)C2=CC=CC=C2 |
| InChIKey | OZDNVEFIVHLBGQ-UHFFFAOYSA-N |
Product Overview
Ethanone, 2-(morpholin-4-yl)-1-phenyl-2-thioxo- (CAS 55548-41-9), with molecular formula C12H13NO2S and molecular weight 235.07 g/mol. IUPAC: 2-morpholin-4-yl-1-phenyl-2-sulfanylideneethanone.
Chemical Property Profile of Ethanone, 2-(morpholin-4-yl)-1-phenyl-2-thioxo-
Property Insights of Ethanone, 2-(morpholin-4-yl)-1-phenyl-2-thioxo-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 2-(morpholin-4-yl)-1-phenyl-2-thioxo-. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanone, 2-(morpholin-4-yl)-1-phenyl-2-thioxo-. Following Lipinski's Rule of Five, Ethanone, 2-(morpholin-4-yl)-1-phenyl-2-thioxo- 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 Ethanone, 2-(morpholin-4-yl)-1-phenyl-2-thioxo-?
The CAS number of Ethanone, 2-(morpholin-4-yl)-1-phenyl-2-thioxo- is 55548-41-9.
What is the molecular formula of Ethanone, 2-(morpholin-4-yl)-1-phenyl-2-thioxo-?
The molecular formula of Ethanone, 2-(morpholin-4-yl)-1-phenyl-2-thioxo- is C12H13NO2S.
What is the molecular weight of Ethanone, 2-(morpholin-4-yl)-1-phenyl-2-thioxo-?
The molecular weight of Ethanone, 2-(morpholin-4-yl)-1-phenyl-2-thioxo- is 235.07 g/mol.
Where can I buy Ethanone, 2-(morpholin-4-yl)-1-phenyl-2-thioxo-?
You can request a quote for Ethanone, 2-(morpholin-4-yl)-1-phenyl-2-thioxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 2-(morpholin-4-yl)-1-phenyl-2-thioxo-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 2-(morpholin-4-yl)-1-phenyl-2-thioxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.