Acetic acid, diphenyl-, 1-((diethylamino)methyl)butyl ester, hydrochloride
TL;DR: Acetic acid, diphenyl-, 1-((diethylamino)methyl)butyl ester, hydrochloride (CAS 10521-39-8) is a chemical compound with molecular formula C23H32ClNO2 and molecular weight 389.21216 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2,2-diphenylacetyl)oxypentyl-diethylazanium chloride
Also Known As: Diphenylacetic acid 1-((diethylamino)methyl)butyl ester hydrochloride, ACETIC ACID, DIPHENYL-, 1-((DIETHYLAMINO)METHYL)BUTYL ESTER, HYDROCHLORIDE, 2-(2,2-diphenylacetyl)oxypentyl-diethylazanium chloride
Technical Specifications
| Molecular Formula | C23H32ClNO2 |
| Molecular Weight | 389.21216 g/mol |
| XLogP | 0.46 |
| Topological Polar Surface Area (TPSA) | 30.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 389.21216 Da |
| Heavy Atoms | 27 |
| Complexity | 364.0 |
| SMILES | CCCC(C[NH+](CC)CC)OC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2.[Cl-] |
| InChIKey | OFEPIXRSHCMFEB-UHFFFAOYSA-N |
Chemical Property Profile of Acetic acid, diphenyl-, 1-((diethylamino)methyl)butyl ester, hydrochloride
Property Insights of Acetic acid, diphenyl-, 1-((diethylamino)methyl)butyl ester, hydrochloride
The XLogP value of 0.46 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, diphenyl-, 1-((diethylamino)methyl)butyl ester, hydrochloride. With a topological polar surface area (TPSA) of 30.7 Ų, Acetic acid, diphenyl-, 1-((diethylamino)methyl)butyl ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, diphenyl-, 1-((diethylamino)methyl)butyl ester, hydrochloride has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Acetic acid, diphenyl-, 1-((diethylamino)methyl)butyl ester, hydrochloride?
The CAS number of Acetic acid, diphenyl-, 1-((diethylamino)methyl)butyl ester, hydrochloride is 10521-39-8.
What is the molecular formula of Acetic acid, diphenyl-, 1-((diethylamino)methyl)butyl ester, hydrochloride?
The molecular formula of Acetic acid, diphenyl-, 1-((diethylamino)methyl)butyl ester, hydrochloride is C23H32ClNO2.
What is the molecular weight of Acetic acid, diphenyl-, 1-((diethylamino)methyl)butyl ester, hydrochloride?
The molecular weight of Acetic acid, diphenyl-, 1-((diethylamino)methyl)butyl ester, hydrochloride is 389.21216 g/mol.
Where can I buy Acetic acid, diphenyl-, 1-((diethylamino)methyl)butyl ester, hydrochloride?
You can request a quote for Acetic acid, diphenyl-, 1-((diethylamino)methyl)butyl ester, hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acetic acid, diphenyl-, 1-((diethylamino)methyl)butyl ester, hydrochloride?
Yes, CoreyChem provides custom synthesis services for Acetic acid, diphenyl-, 1-((diethylamino)methyl)butyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.