RefChem:335309
TL;DR: RefChem:335309 (CAS 101330-09-0) is a chemical compound with molecular formula C17H26ClNO2S and molecular weight 343.13727 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(dimethylamino)ethyl 1-phenylsulfanylcyclohexane-1-carboxylate;hydrochloride
Also Known As: Cyclohexanecarboxylic acid, 1-(phenylthio)-, 2-(dimethylamino)ethyl ester, hydrochloride, 1-(Phenylthio)cyclohexanecarboxylic acid 2-(dimethylamino)ethyl ester hydrochloride, 2-dimethylaminoethyl 1-phenylsulfanylcyclohexane-1-carboxylate hydrochloride, 2-(Dimethylamino)ethyl 1-(phenylsulfanyl)cyclohexane-1-carboxylate--hydrogen chloride (1/1), 2-(dimethylamino)ethyl 1-phenylsulfanylcyclohexane-1-carboxylate,hydrochloride
Technical Specifications
| Molecular Formula | C17H26ClNO2S |
| Molecular Weight | 343.13727 g/mol |
| XLogP | 4.0082 |
| Topological Polar Surface Area (TPSA) | 54.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 343.13727 Da |
| Heavy Atoms | 22 |
| Complexity | 321.0 |
| SMILES | CN(C)CCOC(=O)C1(CCCCC1)SC2=CC=CC=C2.Cl |
| InChIKey | LLFQNUBVQKFJRH-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:335309
Property Insights of RefChem:335309
The XLogP value of 4.0082 indicates that RefChem:335309 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.8 Ų, RefChem:335309 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:335309 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:335309?
The CAS number of RefChem:335309 is 101330-09-0.
What is the molecular formula of RefChem:335309?
The molecular formula of RefChem:335309 is C17H26ClNO2S.
What is the molecular weight of RefChem:335309?
The molecular weight of RefChem:335309 is 343.13727 g/mol.
Where can I buy RefChem:335309?
You can request a quote for RefChem:335309 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:335309?
Yes, CoreyChem provides custom synthesis services for RefChem:335309 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.