2H-1,3-Thiazine-2,4(3H)-dione, dihydro-5-ethyl-5-phenyl-
TL;DR: 2H-1,3-Thiazine-2,4(3H)-dione, dihydro-5-ethyl-5-phenyl- (CAS 7059-31-6) 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.
5-ethyl-5-phenyl-1,3-thiazinane-2,4-dione
Also Known As: 5-ethyl-5-phenyl-1,3-thiazinane-2,4-dione, 5-Etildiidro-5-fenil-1,3-tiazin-2,4-dione, Dihydro-5-ethyl-5-phenyl-2H-1,3-thiazine-2,4(3H)-dione, 2H-1,3-Thiazine-2,4(3H)-dione, dihydro-5-ethyl-5-phenyl-, 5-Etildiidro-5-fenil-1,3-tiazin-2,4-dione [Italian]
| Molecular Formula | C12H13NO2S |
|---|---|
| Molecular Weight | 235.07 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 71.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.0667 |
| Heavy Atoms | 16 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 7059-31-6 |
|---|---|
| SMILES | CCC1(CSC(=O)NC1=O)C2=CC=CC=C2 |
| InChIKey | DUCJTYVEBJXBMM-UHFFFAOYSA-N |
Product Overview
2H-1,3-Thiazine-2,4(3H)-dione, dihydro-5-ethyl-5-phenyl- (CAS 7059-31-6), with molecular formula C12H13NO2S and molecular weight 235.07 g/mol. IUPAC: 5-ethyl-5-phenyl-1,3-thiazinane-2,4-dione.
Chemical Property Profile of 2H-1,3-Thiazine-2,4(3H)-dione, dihydro-5-ethyl-5-phenyl-
Property Insights of 2H-1,3-Thiazine-2,4(3H)-dione, dihydro-5-ethyl-5-phenyl-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1,3-Thiazine-2,4(3H)-dione, dihydro-5-ethyl-5-phenyl-. The TPSA of 71.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-1,3-Thiazine-2,4(3H)-dione, dihydro-5-ethyl-5-phenyl-. Following Lipinski's Rule of Five, 2H-1,3-Thiazine-2,4(3H)-dione, dihydro-5-ethyl-5-phenyl- 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 2H-1,3-Thiazine-2,4(3H)-dione, dihydro-5-ethyl-5-phenyl-?
The CAS number of 2H-1,3-Thiazine-2,4(3H)-dione, dihydro-5-ethyl-5-phenyl- is 7059-31-6.
What is the molecular formula of 2H-1,3-Thiazine-2,4(3H)-dione, dihydro-5-ethyl-5-phenyl-?
The molecular formula of 2H-1,3-Thiazine-2,4(3H)-dione, dihydro-5-ethyl-5-phenyl- is C12H13NO2S.
What is the molecular weight of 2H-1,3-Thiazine-2,4(3H)-dione, dihydro-5-ethyl-5-phenyl-?
The molecular weight of 2H-1,3-Thiazine-2,4(3H)-dione, dihydro-5-ethyl-5-phenyl- is 235.07 g/mol.
Where can I buy 2H-1,3-Thiazine-2,4(3H)-dione, dihydro-5-ethyl-5-phenyl-?
You can request a quote for 2H-1,3-Thiazine-2,4(3H)-dione, dihydro-5-ethyl-5-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1,3-Thiazine-2,4(3H)-dione, dihydro-5-ethyl-5-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1,3-Thiazine-2,4(3H)-dione, dihydro-5-ethyl-5-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.