TL;DR: 8-(Pyridin-2-yl)-5,8-diazaspiro[4.5]decan-5-ium bromide (CAS 142348-17-2) is a chemical compound with molecular formula C13H20BrN3 and molecular weight 297.08405 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-pyridin-2-yl-8-aza-5-azoniaspiro[4.5]decane bromide
Also Known As: 8-(2-pyridyl)-8-aza-5-azoniaspiro[4,5]decane bromide, 8-(pyridin-2-yl)-5,8-diazaspiro[4.5]decan-5-ium bromide, VU0215686-4, 8-pyridin-2-yl-8-aza-5-azoniaspiro[4.5]decane;bromide, 8-(2-pyridyl)-5,8-diazaspiro[4.5]decane, bromide
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C13H20BrN3 |
| Molecular Weight | 297.08405 g/mol |
| XLogP | -1.4838 |
| Topological Polar Surface Area (TPSA) | 16.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 297.08405 Da |
| Heavy Atoms | 17 |
| Complexity | 225.0 |
| SMILES | C1CC[N+]2(C1)CCN(CC2)C3=CC=CC=N3.[Br-] |
| InChIKey | MZVXUPJIQIQYTI-UHFFFAOYSA-M |
The XLogP value of -1.4838 indicates that 8-(Pyridin-2-yl)-5,8-diazaspiro[4.5]decan-5-ium bromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 16.1 Ų, 8-(Pyridin-2-yl)-5,8-diazaspiro[4.5]decan-5-ium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-(Pyridin-2-yl)-5,8-diazaspiro[4.5]decan-5-ium bromide has 0 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 8-(Pyridin-2-yl)-5,8-diazaspiro[4.5]decan-5-ium bromide is 142348-17-2.
The molecular formula of 8-(Pyridin-2-yl)-5,8-diazaspiro[4.5]decan-5-ium bromide is C13H20BrN3.
The molecular weight of 8-(Pyridin-2-yl)-5,8-diazaspiro[4.5]decan-5-ium bromide is 297.08405 g/mol.
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