TL;DR: Butanimidamide, N,N-dimethyl-3-hydroxy-4-(1-naphthalenyloxy)-, monohydrochloride (CAS 35991-94-7) is a chemical compound with molecular formula C16H21ClN2O2 and molecular weight 308.12915 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3-hydroxy-4-naphthalen-1-yloxybutanimidoyl)-dimethylazanium chloride
Also Known As: N,N-Dimethyl-3-hydroxy-4-(1-naphthalenyloxy)butanimidamide hydrochloride, BUTANIMIDAMIDE, N,N-DIMETHYL-3-HYDROXY-4-(1-NAPHTHALENYLOXY)-, MONOHYDROCHLORIDE, 4-alpha-Naphthyloxy-3-hydroxy-N,N-dimethyl-butyramidin-hydrochlorid [German], 4-alpha-Naphthyloxy-3-hydroxy-N,N-dimethyl-butyramidin-hydrochlorid, (3-hydroxy-4-naphthalen-1-yloxybutanimidoyl)-dimethylazanium chloride
| Molecular Formula | C16H21ClN2O2 |
| Molecular Weight | 308.12915 g/mol |
| XLogP | -1.9 |
| Topological Polar Surface Area (TPSA) | 57.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 308.12915 Da |
| Heavy Atoms | 21 |
| Complexity | 320.0 |
| SMILES | C[NH+](C)C(=N)CC(COC1=CC=CC2=CC=CC=C21)O.[Cl-] |
| InChIKey | AVWULCYMXUZBMD-UHFFFAOYSA-N |
The XLogP value of -1.9 indicates that Butanimidamide, N,N-dimethyl-3-hydroxy-4-(1-naphthalenyloxy)-, monohydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 57.8 Ų, Butanimidamide, N,N-dimethyl-3-hydroxy-4-(1-naphthalenyloxy)-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butanimidamide, N,N-dimethyl-3-hydroxy-4-(1-naphthalenyloxy)-, monohydrochloride has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Butanimidamide, N,N-dimethyl-3-hydroxy-4-(1-naphthalenyloxy)-, monohydrochloride is 35991-94-7.
The molecular formula of Butanimidamide, N,N-dimethyl-3-hydroxy-4-(1-naphthalenyloxy)-, monohydrochloride is C16H21ClN2O2.
The molecular weight of Butanimidamide, N,N-dimethyl-3-hydroxy-4-(1-naphthalenyloxy)-, monohydrochloride is 308.12915 g/mol.
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