TL;DR: 2(3H)-Benzofuranone, 3-cyclohexyl-3-(2-(diethylamino)ethyl)-, hydrochloride (CAS 63917-58-8) is a chemical compound with molecular formula C20H30ClNO2 and molecular weight 351.1965 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-cyclohexyl-2-oxo-1-benzofuran-3-yl)ethyl-diethylazanium chloride
Also Known As: AP 73, 2(3H)-BENZOFURANONE, 3-CYCLOHEXYL-3-(2-(DIETHYLAMINO)ETHYL)-, HYDROCHLORIDE, 2-(3-cyclohexyl-2-oxo-1-benzofuran-3-yl)ethyl-diethylazanium chloride, 2(3H)-Benzofuranone, 3-cyclohexyl-3-[2-(diethylamino)ethyl]-, hydrochloride
| Molecular Formula | C20H30ClNO2 |
| Molecular Weight | 351.1965 g/mol |
| XLogP | -0.26 |
| Topological Polar Surface Area (TPSA) | 30.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 351.1965 Da |
| Heavy Atoms | 24 |
| Complexity | 400.0 |
| SMILES | CC[NH+](CC)CCC1(C2=CC=CC=C2OC1=O)C3CCCCC3.[Cl-] |
| InChIKey | BRBRZCHDAPWVRY-UHFFFAOYSA-N |
The XLogP value of -0.26 indicates that 2(3H)-Benzofuranone, 3-cyclohexyl-3-(2-(diethylamino)ethyl)-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 30.7 Ų, 2(3H)-Benzofuranone, 3-cyclohexyl-3-(2-(diethylamino)ethyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2(3H)-Benzofuranone, 3-cyclohexyl-3-(2-(diethylamino)ethyl)-, hydrochloride has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2(3H)-Benzofuranone, 3-cyclohexyl-3-(2-(diethylamino)ethyl)-, hydrochloride is 63917-58-8.
The molecular formula of 2(3H)-Benzofuranone, 3-cyclohexyl-3-(2-(diethylamino)ethyl)-, hydrochloride is C20H30ClNO2.
The molecular weight of 2(3H)-Benzofuranone, 3-cyclohexyl-3-(2-(diethylamino)ethyl)-, hydrochloride is 351.1965 g/mol.
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