TL;DR: Benzamide, o-butoxy-N-(3-(diethylamino)propyl)-, hydrochloride (CAS 78109-81-6) is a chemical compound with molecular formula C18H31ClN2O2 and molecular weight 342.2074 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(2-butoxybenzoyl)amino]propyl-diethylazanium chloride
Also Known As: D-638, o-Butoxy-N-(3-(diethylamino)propyl)benzamide hydrochloride, 2-Butoxybenzoesaeure-3'-diaethylaminopropylamid (1') hydrochlorid [German], BENZAMIDE, o-BUTOXY-N-(3-(DIETHYLAMINO)PROPYL)-, HYDROCHLORIDE, 2-Butoxybenzoesaeure-3'-diaethylaminopropylamid (1') hydrochlorid
| Molecular Formula | C18H31ClN2O2 |
| Molecular Weight | 342.2074 g/mol |
| XLogP | -1.09 |
| Topological Polar Surface Area (TPSA) | 42.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 342.2074 Da |
| Heavy Atoms | 23 |
| Complexity | 293.0 |
| SMILES | CCCCOC1=CC=CC=C1C(=O)NCCC[NH+](CC)CC.[Cl-] |
| InChIKey | WYCWAIKAFWQRCU-UHFFFAOYSA-N |
The XLogP value of -1.09 indicates that Benzamide, o-butoxy-N-(3-(diethylamino)propyl)-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 42.8 Ų, Benzamide, o-butoxy-N-(3-(diethylamino)propyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzamide, o-butoxy-N-(3-(diethylamino)propyl)-, hydrochloride has 2 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 Benzamide, o-butoxy-N-(3-(diethylamino)propyl)-, hydrochloride is 78109-81-6.
The molecular formula of Benzamide, o-butoxy-N-(3-(diethylamino)propyl)-, hydrochloride is C18H31ClN2O2.
The molecular weight of Benzamide, o-butoxy-N-(3-(diethylamino)propyl)-, hydrochloride is 342.2074 g/mol.
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