TL;DR: Phenothiazine, 2-acetyl-10-(3-(4-methoxypiperidino)propyl)-, hydrochloride (CAS 101952-94-7) is a chemical compound with molecular formula C23H29ClN2O2S and molecular weight 432.16382 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[10-[3-(4-methoxypiperidin-1-yl)propyl]phenothiazin-2-yl]ethanone;hydrochloride
Also Known As: Phenothiazine, 2-acetyl-10-(3-(4-methoxypiperidino)propyl)-, hydrochloride, 1-(3-(4-Methoxypiperidino)propyl)-2-acetylphenothiazine hydrochloride, 1-[10-[3-(4-methoxypiperidin-1-yl)propyl]phenothiazin-2-yl]ethanone hydrochloride, 1-{10-[3-(4-Methoxypiperidin-1-yl)propyl]-10H-phenothiazin-2-yl}ethan-1-one--hydrogen chloride (1/1)
| Molecular Formula | C23H29ClN2O2S |
| Molecular Weight | 432.16382 g/mol |
| XLogP | 5.4146 |
| Topological Polar Surface Area (TPSA) | 58.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 432.16382 Da |
| Heavy Atoms | 29 |
| Complexity | 523.0 |
| SMILES | CC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN4CCC(CC4)OC.Cl |
| InChIKey | XXUHSEVSROOOPA-UHFFFAOYSA-N |
The XLogP value of 5.4146 indicates that Phenothiazine, 2-acetyl-10-(3-(4-methoxypiperidino)propyl)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.1 Ų, Phenothiazine, 2-acetyl-10-(3-(4-methoxypiperidino)propyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenothiazine, 2-acetyl-10-(3-(4-methoxypiperidino)propyl)-, hydrochloride has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Phenothiazine, 2-acetyl-10-(3-(4-methoxypiperidino)propyl)-, hydrochloride is 101952-94-7.
The molecular formula of Phenothiazine, 2-acetyl-10-(3-(4-methoxypiperidino)propyl)-, hydrochloride is C23H29ClN2O2S.
The molecular weight of Phenothiazine, 2-acetyl-10-(3-(4-methoxypiperidino)propyl)-, hydrochloride is 432.16382 g/mol.
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