beta-Diisopropylaminoethyl alpha-(2-cyclohexenyl)-alpha-(2-thienyl)-acetate hydrochloride
TL;DR: beta-Diisopropylaminoethyl alpha-(2-cyclohexenyl)-alpha-(2-thienyl)-acetate hydrochloride (CAS 102370-97-8) is a chemical compound with molecular formula C20H32ClNO2S and molecular weight 385.18423 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[di(propan-2-yl)amino]ethyl 2-cyclohex-2-en-1-yl-2-thiophen-2-ylacetate;hydrochloride
Also Known As: beta-Diisopropylaminoethyl alpha-(2-cyclohexenyl)-alpha-(2-thienyl)-acetate hydrochloride, 2-Thiopheneacetic acid, alpha-2-cyclohexen-1-yl-, 2-diisopropylaminoethyl ester, hydrochloride, alpha-2-Cyclohexen-1-yl-2-thiopheneacetic acid 2-diisopropylaminoethyl ester hydrochloride, 2-(diisopropylamino)ethyl 2-cyclohexen-1-yl(2-thienyl)acetate hydrochloride, 2-(dipropan-2-ylamino)ethyl 2-(1-cyclohex-2-enyl)-2-thiophen-2-yl-acetate Hydrochloride
Technical Specifications
| Molecular Formula | C20H32ClNO2S |
| Molecular Weight | 385.18423 g/mol |
| XLogP | 5.2718 |
| Topological Polar Surface Area (TPSA) | 57.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 385.18423 Da |
| Heavy Atoms | 25 |
| Complexity | 414.0 |
| SMILES | CC(C)N(CCOC(=O)C(C1CCCC=C1)C2=CC=CS2)C(C)C.Cl |
| InChIKey | IMMNYBXOHBGVBQ-UHFFFAOYSA-N |
Chemical Property Profile of beta-Diisopropylaminoethyl alpha-(2-cyclohexenyl)-alpha-(2-thienyl)-acetate hydrochloride
Property Insights of beta-Diisopropylaminoethyl alpha-(2-cyclohexenyl)-alpha-(2-thienyl)-acetate hydrochloride
The XLogP value of 5.2718 indicates that beta-Diisopropylaminoethyl alpha-(2-cyclohexenyl)-alpha-(2-thienyl)-acetate hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.8 Ų, beta-Diisopropylaminoethyl alpha-(2-cyclohexenyl)-alpha-(2-thienyl)-acetate hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, beta-Diisopropylaminoethyl alpha-(2-cyclohexenyl)-alpha-(2-thienyl)-acetate hydrochloride has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of beta-Diisopropylaminoethyl alpha-(2-cyclohexenyl)-alpha-(2-thienyl)-acetate hydrochloride?
The CAS number of beta-Diisopropylaminoethyl alpha-(2-cyclohexenyl)-alpha-(2-thienyl)-acetate hydrochloride is 102370-97-8.
What is the molecular formula of beta-Diisopropylaminoethyl alpha-(2-cyclohexenyl)-alpha-(2-thienyl)-acetate hydrochloride?
The molecular formula of beta-Diisopropylaminoethyl alpha-(2-cyclohexenyl)-alpha-(2-thienyl)-acetate hydrochloride is C20H32ClNO2S.
What is the molecular weight of beta-Diisopropylaminoethyl alpha-(2-cyclohexenyl)-alpha-(2-thienyl)-acetate hydrochloride?
The molecular weight of beta-Diisopropylaminoethyl alpha-(2-cyclohexenyl)-alpha-(2-thienyl)-acetate hydrochloride is 385.18423 g/mol.
Where can I buy beta-Diisopropylaminoethyl alpha-(2-cyclohexenyl)-alpha-(2-thienyl)-acetate hydrochloride?
You can request a quote for beta-Diisopropylaminoethyl alpha-(2-cyclohexenyl)-alpha-(2-thienyl)-acetate hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for beta-Diisopropylaminoethyl alpha-(2-cyclohexenyl)-alpha-(2-thienyl)-acetate hydrochloride?
Yes, CoreyChem provides custom synthesis services for beta-Diisopropylaminoethyl alpha-(2-cyclohexenyl)-alpha-(2-thienyl)-acetate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.