2H-Thiopyran-4-ol, tetrahydro-3-((dimethylamino)methyl)-4-(4-(trifluoromethyl)phenyl)-, hydrochloride, trans-(+-)-
TL;DR: 2H-Thiopyran-4-ol, tetrahydro-3-((dimethylamino)methyl)-4-(4-(trifluoromethyl)phenyl)-, hydrochloride, trans-(+-)- (CAS 119558-37-1) is a chemical compound with molecular formula C15H21ClF3NOS and molecular weight 355.09845 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3R,4S)-3-[(dimethylamino)methyl]-4-[4-(trifluoromethyl)phenyl]thian-4-ol;hydrochloride
Also Known As: 2H-Thiopyran-4-ol, tetrahydro-3-((dimethylamino)methyl)-4-(4-(trifluoromethyl)phenyl)-, hydrochloride, trans-(+-)-, (3R,4S)-3-(dimethylaminomethyl)-4-[4-(trifluoromethyl)phenyl]thian-4-ol hydrochloride, (3S,4S)-3-(dimethylaminomethyl)-4-[4-(trifluoromethyl)phenyl]thian-4-ol Hydrochloride, 1,5-Anhydro-2,4-dideoxy-2-[(dimethylamino)methyl]-1-thio-3-C-[4-(trifluoromethyl)phenyl]-L-threo-pentitol--hydrogen chloride (1/1)
Technical Specifications
| Molecular Formula | C15H21ClF3NOS |
| Molecular Weight | 355.09845 g/mol |
| XLogP | 3.6295 |
| Topological Polar Surface Area (TPSA) | 48.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 355.09845 Da |
| Heavy Atoms | 22 |
| Complexity | 342.0 |
| SMILES | CN(C)C[C@H]1CSCC[C@]1(C2=CC=C(C=C2)C(F)(F)F)O.Cl |
| InChIKey | HRXLXVPKEJCATR-LMRHVHIWSA-N |
Chemical Property Profile of 2H-Thiopyran-4-ol, tetrahydro-3-((dimethylamino)methyl)-4-(4-(trifluoromethyl)phenyl)-, hydrochloride, trans-(+-)-
Property Insights of 2H-Thiopyran-4-ol, tetrahydro-3-((dimethylamino)methyl)-4-(4-(trifluoromethyl)phenyl)-, hydrochloride, trans-(+-)-
The XLogP value of 3.6295 indicates that 2H-Thiopyran-4-ol, tetrahydro-3-((dimethylamino)methyl)-4-(4-(trifluoromethyl)phenyl)-, hydrochloride, trans-(+-)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.8 Ų, 2H-Thiopyran-4-ol, tetrahydro-3-((dimethylamino)methyl)-4-(4-(trifluoromethyl)phenyl)-, hydrochloride, trans-(+-)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-Thiopyran-4-ol, tetrahydro-3-((dimethylamino)methyl)-4-(4-(trifluoromethyl)phenyl)-, hydrochloride, trans-(+-)- has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2H-Thiopyran-4-ol, tetrahydro-3-((dimethylamino)methyl)-4-(4-(trifluoromethyl)phenyl)-, hydrochloride, trans-(+-)-?
The CAS number of 2H-Thiopyran-4-ol, tetrahydro-3-((dimethylamino)methyl)-4-(4-(trifluoromethyl)phenyl)-, hydrochloride, trans-(+-)- is 119558-37-1.
What is the molecular formula of 2H-Thiopyran-4-ol, tetrahydro-3-((dimethylamino)methyl)-4-(4-(trifluoromethyl)phenyl)-, hydrochloride, trans-(+-)-?
The molecular formula of 2H-Thiopyran-4-ol, tetrahydro-3-((dimethylamino)methyl)-4-(4-(trifluoromethyl)phenyl)-, hydrochloride, trans-(+-)- is C15H21ClF3NOS.
What is the molecular weight of 2H-Thiopyran-4-ol, tetrahydro-3-((dimethylamino)methyl)-4-(4-(trifluoromethyl)phenyl)-, hydrochloride, trans-(+-)-?
The molecular weight of 2H-Thiopyran-4-ol, tetrahydro-3-((dimethylamino)methyl)-4-(4-(trifluoromethyl)phenyl)-, hydrochloride, trans-(+-)- is 355.09845 g/mol.
Where can I buy 2H-Thiopyran-4-ol, tetrahydro-3-((dimethylamino)methyl)-4-(4-(trifluoromethyl)phenyl)-, hydrochloride, trans-(+-)-?
You can request a quote for 2H-Thiopyran-4-ol, tetrahydro-3-((dimethylamino)methyl)-4-(4-(trifluoromethyl)phenyl)-, hydrochloride, trans-(+-)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2H-Thiopyran-4-ol, tetrahydro-3-((dimethylamino)methyl)-4-(4-(trifluoromethyl)phenyl)-, hydrochloride, trans-(+-)-?
Yes, CoreyChem provides custom synthesis services for 2H-Thiopyran-4-ol, tetrahydro-3-((dimethylamino)methyl)-4-(4-(trifluoromethyl)phenyl)-, hydrochloride, trans-(+-)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.