p-Anisic acid, thio-, O-2-(diethylamino)ethyl ester, hydrochloride
TL;DR: p-Anisic acid, thio-, O-2-(diethylamino)ethyl ester, hydrochloride (CAS 15504-09-3) is a chemical compound with molecular formula C14H22ClNO2S and molecular weight 303.106 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-(diethylamino)ethyl]-4-methoxybenzenecarbothioic S-acid;hydrochloride
Also Known As: p-Anisic acid, thio-, O-2-(diethylamino)ethyl ester, hydrochloride, Thio-p-anisic acid O-2-(diethylamino)ethyl ester hydrochloride, 2-(2-diethylaminoethyl)-4-methoxybenzenecarbothioic S-acid hydrochloride, 2-[2-(Diethylamino)ethyl]-4-methoxybenzene-1-carbothioic S-acid--hydrogen chloride (1/1)
Technical Specifications
| Molecular Formula | C14H22ClNO2S |
| Molecular Weight | 303.106 g/mol |
| XLogP | 3.0713 |
| Topological Polar Surface Area (TPSA) | 30.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 303.106 Da |
| Heavy Atoms | 19 |
| Complexity | 256.0 |
| SMILES | CCN(CC)CCC1=C(C=CC(=C1)OC)C(=O)S.Cl |
| InChIKey | LBHFNTZLMYSPPE-UHFFFAOYSA-N |
Chemical Property Profile of p-Anisic acid, thio-, O-2-(diethylamino)ethyl ester, hydrochloride
Property Insights of p-Anisic acid, thio-, O-2-(diethylamino)ethyl ester, hydrochloride
The XLogP value of 3.0713 indicates that p-Anisic acid, thio-, O-2-(diethylamino)ethyl ester, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.5 Ų, p-Anisic acid, thio-, O-2-(diethylamino)ethyl ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Anisic acid, thio-, O-2-(diethylamino)ethyl ester, hydrochloride has 2 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 p-Anisic acid, thio-, O-2-(diethylamino)ethyl ester, hydrochloride?
The CAS number of p-Anisic acid, thio-, O-2-(diethylamino)ethyl ester, hydrochloride is 15504-09-3.
What is the molecular formula of p-Anisic acid, thio-, O-2-(diethylamino)ethyl ester, hydrochloride?
The molecular formula of p-Anisic acid, thio-, O-2-(diethylamino)ethyl ester, hydrochloride is C14H22ClNO2S.
What is the molecular weight of p-Anisic acid, thio-, O-2-(diethylamino)ethyl ester, hydrochloride?
The molecular weight of p-Anisic acid, thio-, O-2-(diethylamino)ethyl ester, hydrochloride is 303.106 g/mol.
Where can I buy p-Anisic acid, thio-, O-2-(diethylamino)ethyl ester, hydrochloride?
You can request a quote for p-Anisic acid, thio-, O-2-(diethylamino)ethyl ester, hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for p-Anisic acid, thio-, O-2-(diethylamino)ethyl ester, hydrochloride?
Yes, CoreyChem provides custom synthesis services for p-Anisic acid, thio-, O-2-(diethylamino)ethyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.