TL;DR: Butyrophenone, 4-(cyclopentylamino)-4'-fluoro-, hydrochloride (CAS 59921-77-6) is a chemical compound with molecular formula C15H21ClFNO and molecular weight 285.12958 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
cyclopentyl-[4-(4-fluorophenyl)-4-oxobutyl]azanium chloride
Also Known As: 4-(Cyclopentylamino)-4'-fluorobutyrophenone hydrochloride, BUTYROPHENONE, 4-(CYCLOPENTYLAMINO)-4'-FLUORO-, HYDROCHLORIDE, cyclopentyl-[4-(4-fluorophenyl)-4-oxobutyl]azanium chloride
| Molecular Formula | C15H21ClFNO |
| Molecular Weight | 285.12958 g/mol |
| XLogP | -0.7 |
| Topological Polar Surface Area (TPSA) | 33.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 285.12958 Da |
| Heavy Atoms | 19 |
| Complexity | 255.0 |
| SMILES | C1CCC(C1)[NH2+]CCCC(=O)C2=CC=C(C=C2)F.[Cl-] |
| InChIKey | GTVVQMSSZWWQJP-UHFFFAOYSA-N |
The XLogP value of -0.7 indicates that Butyrophenone, 4-(cyclopentylamino)-4'-fluoro-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 33.7 Ų, Butyrophenone, 4-(cyclopentylamino)-4'-fluoro-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyrophenone, 4-(cyclopentylamino)-4'-fluoro-, 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 Butyrophenone, 4-(cyclopentylamino)-4'-fluoro-, hydrochloride is 59921-77-6.
The molecular formula of Butyrophenone, 4-(cyclopentylamino)-4'-fluoro-, hydrochloride is C15H21ClFNO.
The molecular weight of Butyrophenone, 4-(cyclopentylamino)-4'-fluoro-, hydrochloride is 285.12958 g/mol.
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