4H-1,3-Thiazine, 5,6-dihydro-4,4-dimethyl-2-phenyl-
TL;DR: 4H-1,3-Thiazine, 5,6-dihydro-4,4-dimethyl-2-phenyl- (CAS 881-55-0) is a chemical compound with molecular formula C12H15NS and molecular weight 205.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-dimethyl-2-phenyl-5,6-dihydro-1,3-thiazine
Also Known As: 4H-1,3-Thiazine, 5,6-dihydro-4,4-dimethyl-2-phenyl-, 4,4-dimethyl-2-phenyl-5,6-dihydro-4h-1,3-thiazine, 5,6-Dihydro-4,4-dimethyl-2-phenyl-4H-1,3-thiazine, 4,4-dimethyl-2-phenyl-5,6-dihydro-1,3-thiazine, 4,4-dimethyl-2-phenyl-5,6-dihydro-4H-[1,3]thiazine
| Molecular Formula | C12H15NS |
|---|---|
| Molecular Weight | 205.09 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 37.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 205.09251 |
| Heavy Atoms | 14 |
| Complexity | 226.0 |
Chemical Identifiers
| CAS Number | 881-55-0 |
|---|---|
| SMILES | CC1(CCSC(=N1)C2=CC=CC=C2)C |
| InChIKey | XODSHKNYWZYQAH-UHFFFAOYSA-N |
Product Overview
4H-1,3-Thiazine, 5,6-dihydro-4,4-dimethyl-2-phenyl- (CAS 881-55-0), with molecular formula C12H15NS and molecular weight 205.09 g/mol. IUPAC: 4,4-dimethyl-2-phenyl-5,6-dihydro-1,3-thiazine.
Chemical Property Profile of 4H-1,3-Thiazine, 5,6-dihydro-4,4-dimethyl-2-phenyl-
Property Insights of 4H-1,3-Thiazine, 5,6-dihydro-4,4-dimethyl-2-phenyl-
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-1,3-Thiazine, 5,6-dihydro-4,4-dimethyl-2-phenyl-. With a topological polar surface area (TPSA) of 37.7 Ų, 4H-1,3-Thiazine, 5,6-dihydro-4,4-dimethyl-2-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-1,3-Thiazine, 5,6-dihydro-4,4-dimethyl-2-phenyl- has 0 hydrogen bond donor(s) and 2 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 4H-1,3-Thiazine, 5,6-dihydro-4,4-dimethyl-2-phenyl-?
The CAS number of 4H-1,3-Thiazine, 5,6-dihydro-4,4-dimethyl-2-phenyl- is 881-55-0.
What is the molecular formula of 4H-1,3-Thiazine, 5,6-dihydro-4,4-dimethyl-2-phenyl-?
The molecular formula of 4H-1,3-Thiazine, 5,6-dihydro-4,4-dimethyl-2-phenyl- is C12H15NS.
What is the molecular weight of 4H-1,3-Thiazine, 5,6-dihydro-4,4-dimethyl-2-phenyl-?
The molecular weight of 4H-1,3-Thiazine, 5,6-dihydro-4,4-dimethyl-2-phenyl- is 205.09 g/mol.
Where can I buy 4H-1,3-Thiazine, 5,6-dihydro-4,4-dimethyl-2-phenyl-?
You can request a quote for 4H-1,3-Thiazine, 5,6-dihydro-4,4-dimethyl-2-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-1,3-Thiazine, 5,6-dihydro-4,4-dimethyl-2-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 4H-1,3-Thiazine, 5,6-dihydro-4,4-dimethyl-2-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.